1,2,4-trimethylbenzene

Summary of extracted biomedical information

1,2,4-trimethylbenzene is associated with abnormalities such as Asthma and Rhinitis. The involved biomedical functions are known as Drug Kinetics. 1,2,4-trimethylbenzene is associated with undecane, decane, n-dodecane, Toluene and 2,2,4-trimethylpentane.
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Associated references with human 7

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Journal Year Authors & PubMed Link
A review of the volatiles from the healthy human body. J Breath Res 2014 B. de Lacy Costello, A. Amann, H. Al-Kateb, C. Flynn, W. Filipiak, T. Khalid, D. Osborne, NM. Ratcliffe
J Breath Res 2014 Mar;8(1):014001. PubMed:24421258
Solid phase microextraction, mass spectrometry and metabolomic approaches for detection of potential urinary cancer biomarkers--a powerful strategy for breast cancer diagnosis. Talanta 2012 CL. Silva, M. Passos, JS. Câmara
Talanta 2012 Jan;89:360-8. PubMed:22284503
Quantitative assessments of indoor air pollution and respiratory health in a population-based sample of French dwellings. Environ. Res. 2011 C. Billionnet, E. Gay, S. Kirchner, B. Leynaert, I. Annesi-Maesano
Environ. Res. 2011 Apr;111(3):425-34. PubMed:21397225
Model development and validation of personal exposure to volatile organic compound concentrations. Environ. Health Perspect. 2009 JM. Delgado-Saborit, NJ. Aquilina, C. Meddings, S. Baker, RM. Harrison
Environ. Health Perspect. 2009 Oct;117(10):1571-9. PubMed:20019908
Quantitative structure-property relationships for interspecies extrapolation of the inhalation pharmacokinetics of organic chemicals. Chem. Res. Toxicol. 2005 M. Béliveau, J. Lipscomb, R. Tardif, K. Krishnan
Chem. Res. Toxicol. 2005 Mar;18(3):475-85. PubMed:15777087
Biodegradation of petroleum hydrocarbon vapors: laboratory studies on rates and kinetics in unsaturated alluvial sand. J. Contam. Hydrol. 2003 P. Höhener, C. Duwig, G. Pasteris, K. Kaufmann, N. Dakhel, H. Harms
J. Contam. Hydrol. 2003 Oct;66(1-2):93-115. PubMed:14516943
In situ analysis of solvents on breath and blood: a selected ion flow tube mass spectrometric study. Rapid Commun. Mass Spectrom. 2002 PF. Wilson, CG. Freeman, MJ. McEwan, DB. Milligan, RA. Allardyce, GM. Shaw
Rapid Commun. Mass Spectrom. 2002 ;16(5):427-32. PubMed:11857727

Associated curated diseases 0

No curated diseases are identified in current reference collection.

Associated abnormalities 2

Concept Name External ID Weighted Score Hits References
Asthma ICD9-CM:493.9 972.0 2
  1. Quantitative assessments of indoor air pollution and respiratory health in a population-based sample of French dwellings.
    C. Billionnet, E. Gay, S. Kirchner, B. Leynaert, I. Annesi-Maesano (2011) Environ. Res.
Rhinitis 1000.0 1
  1. Quantitative assessments of indoor air pollution and respiratory health in a population-based sample of French dwellings.
    C. Billionnet, E. Gay, S. Kirchner, B. Leynaert, I. Annesi-Maesano (2011) Environ. Res.

Associated chemicals 23

Concept Name External ID Definition Weighted Score Hits References
undecane 944.0 3
  1. Quantitative assessments of indoor air pollution and respiratory health in a population-based sample of French dwellings.
    C. Billionnet, E. Gay, S. Kirchner, B. Leynaert, I. Annesi-Maesano (2011) Environ. Res.
decane 944.0 3
  1. Biodegradation of petroleum hydrocarbon vapors: laboratory studies on rates and kinetics in unsaturated alluvial sand.
    P. Höhener, C. Duwig, G. Pasteris, K. Kaufmann, N. Dakhel, H. Harms (2003) J. Contam. Hydrol.
  2. Quantitative assessments of indoor air pollution and respiratory health in a population-based sample of French dwellings.
    C. Billionnet, E. Gay, S. Kirchner, B. Leynaert, I. Annesi-Maesano (2011) Environ. Res.
n-dodecane 1000.0 2
  1. Biodegradation of petroleum hydrocarbon vapors: laboratory studies on rates and kinetics in unsaturated alluvial sand.
    P. Höhener, C. Duwig, G. Pasteris, K. Kaufmann, N. Dakhel, H. Harms (2003) J. Contam. Hydrol.
Toluene CHEBI:17578 1000.0 2
  1. Biodegradation of petroleum hydrocarbon vapors: laboratory studies on rates and kinetics in unsaturated alluvial sand.
    P. Höhener, C. Duwig, G. Pasteris, K. Kaufmann, N. Dakhel, H. Harms (2003) J. Contam. Hydrol.
  2. Quantitative assessments of indoor air pollution and respiratory health in a population-based sample of French dwellings.
    C. Billionnet, E. Gay, S. Kirchner, B. Leynaert, I. Annesi-Maesano (2011) Environ. Res.
2,2,4-trimethylpentane 704.55 1
  1. Biodegradation of petroleum hydrocarbon vapors: laboratory studies on rates and kinetics in unsaturated alluvial sand.
    P. Höhener, C. Duwig, G. Pasteris, K. Kaufmann, N. Dakhel, H. Harms (2003) J. Contam. Hydrol.
Cyclic alkane 1000.0 1
  1. Biodegradation of petroleum hydrocarbon vapors: laboratory studies on rates and kinetics in unsaturated alluvial sand.
    P. Höhener, C. Duwig, G. Pasteris, K. Kaufmann, N. Dakhel, H. Harms (2003) J. Contam. Hydrol.
pentane 1000.0 1
  1. Biodegradation of petroleum hydrocarbon vapors: laboratory studies on rates and kinetics in unsaturated alluvial sand.
    P. Höhener, C. Duwig, G. Pasteris, K. Kaufmann, N. Dakhel, H. Harms (2003) J. Contam. Hydrol.
3-xylene 1000.0 1
  1. Biodegradation of petroleum hydrocarbon vapors: laboratory studies on rates and kinetics in unsaturated alluvial sand.
    P. Höhener, C. Duwig, G. Pasteris, K. Kaufmann, N. Dakhel, H. Harms (2003) J. Contam. Hydrol.
octane 1000.0 1
  1. Biodegradation of petroleum hydrocarbon vapors: laboratory studies on rates and kinetics in unsaturated alluvial sand.
    P. Höhener, C. Duwig, G. Pasteris, K. Kaufmann, N. Dakhel, H. Harms (2003) J. Contam. Hydrol.
trichlorotrifluoroethane 645.83 1
  1. Biodegradation of petroleum hydrocarbon vapors: laboratory studies on rates and kinetics in unsaturated alluvial sand.
    P. Höhener, C. Duwig, G. Pasteris, K. Kaufmann, N. Dakhel, H. Harms (2003) J. Contam. Hydrol.
Acetaldehyde CHEBI:15343 1000.0 1
  1. Quantitative assessments of indoor air pollution and respiratory health in a population-based sample of French dwellings.
    C. Billionnet, E. Gay, S. Kirchner, B. Leynaert, I. Annesi-Maesano (2011) Environ. Res.
n-butoxyethanol 1000.0 1
  1. Quantitative assessments of indoor air pollution and respiratory health in a population-based sample of French dwellings.
    C. Billionnet, E. Gay, S. Kirchner, B. Leynaert, I. Annesi-Maesano (2011) Environ. Res.
1-methoxy-2-propanol 1000.0 1
  1. Quantitative assessments of indoor air pollution and respiratory health in a population-based sample of French dwellings.
    C. Billionnet, E. Gay, S. Kirchner, B. Leynaert, I. Annesi-Maesano (2011) Environ. Res.
Hydrocarbons, Halogenated CHEBI:24472 980.0 1
  1. Quantitative assessments of indoor air pollution and respiratory health in a population-based sample of French dwellings.
    C. Billionnet, E. Gay, S. Kirchner, B. Leynaert, I. Annesi-Maesano (2011) Environ. Res.
Aliphatic hydrocarbon 1000.0 1
  1. Quantitative assessments of indoor air pollution and respiratory health in a population-based sample of French dwellings.
    C. Billionnet, E. Gay, S. Kirchner, B. Leynaert, I. Annesi-Maesano (2011) Environ. Res.
4-xylene 950.5 1
  1. Quantitative assessments of indoor air pollution and respiratory health in a population-based sample of French dwellings.
    C. Billionnet, E. Gay, S. Kirchner, B. Leynaert, I. Annesi-Maesano (2011) Environ. Res.
Hydrocarbons, Aromatic CHEBI:33658 977.27 1
  1. Quantitative assessments of indoor air pollution and respiratory health in a population-based sample of French dwellings.
    C. Billionnet, E. Gay, S. Kirchner, B. Leynaert, I. Annesi-Maesano (2011) Environ. Res.
Glycol 944.0 1
  1. Quantitative assessments of indoor air pollution and respiratory health in a population-based sample of French dwellings.
    C. Billionnet, E. Gay, S. Kirchner, B. Leynaert, I. Annesi-Maesano (2011) Environ. Res.
n-hexanal 1000.0 1
  1. Quantitative assessments of indoor air pollution and respiratory health in a population-based sample of French dwellings.
    C. Billionnet, E. Gay, S. Kirchner, B. Leynaert, I. Annesi-Maesano (2011) Environ. Res.
ethyl-n-butyl ketone 775.0 1
  1. Solid phase microextraction, mass spectrometry and metabolomic approaches for detection of potential urinary cancer biomarkers--a powerful strategy for breast cancer diagnosis.
    CL. Silva, M. Passos, JS. Câmara (2012) Talanta
dimethyl disulfide 1000.0 1
  1. Solid phase microextraction, mass spectrometry and metabolomic approaches for detection of potential urinary cancer biomarkers--a powerful strategy for breast cancer diagnosis.
    CL. Silva, M. Passos, JS. Câmara (2012) Talanta
Phenols CHEBI:33853 896.57 1
  1. Solid phase microextraction, mass spectrometry and metabolomic approaches for detection of potential urinary cancer biomarkers--a powerful strategy for breast cancer diagnosis.
    CL. Silva, M. Passos, JS. Câmara (2012) Talanta
Aldehydes CHEBI:17478 1000.0 1
  1. Quantitative assessments of indoor air pollution and respiratory health in a population-based sample of French dwellings.
    C. Billionnet, E. Gay, S. Kirchner, B. Leynaert, I. Annesi-Maesano (2011) Environ. Res.

Associated functions 1

Concept Name External ID Definition Weighted Score Hits References
Drug Kinetics 1000.0 1
  1. Quantitative structure-property relationships for physiologically based pharmacokinetic modeling of volatile organic chemicals in rats.
    M. Béliveau, R. Tardif, K. Krishnan (2003) Toxicol. Appl. Pharmacol.

Associated genes 0

No associated genes are detected in current reference collection.

There are 7 associated references with 1,2,4-trimethylbenzene. Due to lack of full text of references or no associated genes are detected in our text-mining workflow, we cannot extract any gene terms from the associated reference collection.

Chemical Information

Formula C9H12
Mass 120.195
Synonyms 1,2,4-TRIMETHYLBENZENE
Pseudocumene
95-63-6
Pseudocumol
Psi-cumene
as-Trimethylbenzene
1,3,4-Trimethylbenzene
Benzene, 1,2,4-trimethyl-
Uns-trimethylbenzene
1,2,5-Trimethylbenzene
Asymmetrical trimethylbenzene
.psi.-Cumene
Benzene, 1,2,5-trimethyl-
pseudo-cumene
1,2,4-trimethyl-benzene
1,2,4-Trimethyl benzene
NSC 65600
UNII-34X0W8052F
HSDB 5293
EINECS 202-436-9
AI3-03976
CHEBI:34039
GWHJZXXIDMPWGX-UHFFFAOYSA-N
34X0W8052F
DSSTox_CID_1402
DSSTox_RID_76140
DSSTox_GSID_21402
CAS-95-63-6
1,2,4-Trimethylbenzene, analytical standard
pseudo cumene
CCRIS 8146
1,4-Trimethylbenzene
laquo Psiraquo -Cumene
1,2,4 trimethylbenzene
Benzene,2,4-trimethyl-
1,2,5-trimethyl-benzene
1,2, 4-Trimethylbenzene
ACMC-20ap77
EC 202-436-9
AC1L1OC7
Trimethyl benzene (Related)
BIDD:ER0682
ScintiVerse&trade
II Cocktail
ScintiVerse&trade
LC Cocktail
1.2.4-TRIMETHYLBENZENE
CHEMBL1797280
DTXSID6021402
WLN: 1R B1 D1
CTK3J0662
KS-00000WXY
1,2,4-Trimethylbenzene, 98%
MolPort-019-361-390
LABOTEST-BB LTBB001896
NSC65600
ZINC1692473
Tox21_200518
Tox21_300049
NSC-65600
SBB060396
STL268868
AKOS000120059
1,2,4-Trimethylbenzene (pseudocumene)
AS00262
LS-7737
MCULE-5935311187
RTR-029817
TRA0086930
NCGC00247891-01
NCGC00247891-02
NCGC00254118-01
NCGC00258072-01
1,2,4-Trimethylbenzene, 98% 500g
AJ-30145
AN-24325
CJ-28236
KB-10020
SC-46730
1,2,4-Trimethylbenzene (ACD/Name 4.0)
KB-149700
TR-029817
FT-0606255
S0662
ST24036666
ST51046585
X8415
C14533
213343-EP2380867A1
1,2,4-Trimethylbenzene 100 microg/mL in Methanol
I14-20043
F0001-2275
Z1262252998
UNII-A3F3279Q14 component GWHJZXXIDMPWGX-UHFFFAOYSA-N
1,2,4-Trimethylbenzene, certified reference material, TraceCERT(R)
InChI=1/C9H12/c1-7-4-5-8(2)9(3)6-7/h4-6H,1-3H
95-36-3
XBZ
PubChem CID 7247