Benzene

Possibly Marketed Outside US

First approved in 2016

Details

Stereochemistry	ACHIRAL
Molecular Formula	C6H6
Molecular Weight	78.1118
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C1=CC=CC=C1

InChI

InChIKey=UHOVQNZJYSORNB-UHFFFAOYSA-N

InChI=1S/C6H6/c1-2-4-6-5-3-1/h1-6H

HIDE SMILES / InChI

Molecular Formula	C6H6
Molecular Weight	78.1118
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Description
Sources: http://pubs.acs.org/doi/pdf/10.1021/ja01273a045

Phenyl sodium is organometallic compound. It is used to carry exchange reactions to produce phenylmalonic acid.

Originator

Approval Year

Conditions

Condition	Modality	Targets	Highest Phase	Product
Unknown 2596

PubMed

Title	Date	PubMed
Formation and inhibition of chloroaromatic micropollutants formed in incineration processes.	2001-04	11233817
Air pollution from traffic at the residence of children with cancer.	2001-03-01	11226975
Oxidation of polychlorinated benzenes by genetically engineered CYP101 (cytochrome P450(cam)).	2001-03	11231299
Induction and time-dependent accumulation of micronuclei in peripheral blood of transgenic p53+/- mice, Tg.AC (v-Ha-ras) and parental wild-type (C57BL/6 and FVB/N) mice exposed to benzene by inhalation.	2001-03	11230560
Investigation of the in vitro metabolism profile of a phosphodiesterase-IV inhibitor, CDP-840: leading to structural optimization.	2001-03	11181489
In vitro inhibition of cytochrome P450 enzymes in human liver microsomes by a potent CYP2A6 inhibitor, trans-2-phenylcyclopropylamine (tranylcypromine), and its nonamine analog, cyclopropylbenzene.	2001-03	11181487
Interactions of tryptamine derivatives with serotonin transporter species variants implicate transmembrane domain I in substrate recognition.	2001-03	11179447
Amino acid residues critical for differential inhibition of CYP2B4, CYP2B5, and CYP2B1 by phenylimidazoles.	2001-03	11179442
Characterization of emissions during the heating of tyre contaminated scrap.	2001-02-24	11219712
An experimental and numerical study of the thermal oxidation of chlorobenzene.	2001-02-24	11219697
Thermal destruction of benzene.	2001-02-24	11219684
Hazardous air pollutants formation from reactions of raw meal organics in cement kilns.	2001-02-24	11219674
Benzene-induced myelodysplastic syndrome.	2001-02-24	11206698
DFT/ECP study of C-H activation by (PCP)Ir and (PCP)Ir(H)2(PCP=eta3-1,3-C6H3(CH2PR2)2). Enthalpies and free energies of associative and dissociative pathways.	2001-02-24	11206383
Photorearrangement of vinylidenecyclopropanes to 1,2,3-butatriene derivatives.	2001-02-22	11178830
Multicomponent polyanions. 57. Large-angle X-ray scattering study of aqueous molybdophenylphosphonate solutions.	2001-02-12	11225097
Miniaturized solid-phase extraction with resin disks.	2001-02-09	11218144
Preparation and applications of polypyrrole films in solid-phase microextraction.	2001-02-09	11218140
Combining membrane extraction with mobile gas chromatography for the field analysis of volatile organic compounds in contaminated waters.	2001-02-09	11218139
Application of on-site solid-phase microextraction in aquatic dissipation studies of profoxydim in rice.	2001-02-09	11218138
Adsorbate-substrate vibrational modes of benzene on Ag(110) resolved with scanning tunneling spectroscopy.	2001-02-05	11178007
Protective effects of SM-20302, an orally active GPIIb/IIIa antagonist, in an ADP/epinephrine-induced guinea pig model of transient cerebral ischemia.	2001-02-01	11228335
Photocleavage of DNA by 4'-bromoacetophenone analogs.	2001-02	11235810
Caffeic acid phenethyl ester (CAPE): synthesis and X-ray crystallographic analysis.	2001-02	11217116
Phosphodiesterase 4 isoenzyme inhibitory activity of 3-phenylxanthines and 4-pheny.	2001-02	11217107
Absorption spectroscopic study of EDA complexes of.	2001-02	11206565
Sensitive and rapid method for the simultaneous quantification of the HIV-protease inhibitors indinavir, nelfinavir, ritonavir, and saquinavir in human plasma by reversed-phase liquid chromatography.	2001-02	11206045
Urinary benzene as a biomarker of exposure among occupationally exposed and unexposed subjects.	2001-02	11181449
Antagonists of the human CCR5 receptor as anti-HIV-1 agents. Part 2: structure-activity relationships for substituted 2-Aryl-1-[N-(methyl)-N-(phenylsulfonyl)amino]-4-(piperidin-1-yl)butanes.	2001-01-22	11206474
Design and synthesis of sialyl Lewis x mimics as E-selectin inhibitors.	2001-01-22	11206447
Characterization of the polarity of reversed-phase liquid chromatographic stationary phases in the presence of 1-propanol using solvatochromism and multivariate curve resolution.	2001-01-15	11199980
Towards a correlation of absolute configuration and chiroptical properties of alkyl aryl sulfoxides: a coupled-oscillator foundation of the empirical Mislow rule?	2001-01-05	11205028
Self-assembly and selective guest binding of three-dimensional open-framework solids from a macrocyclic complex as a trifunctional metal building block.	2001-01-05	11205024
Quantification of derivatives of bisphenol A diglycidyl ether (BADGE) and novolac glycidyl ether (NOGE) migrated from can coatings into tuna by HPLC/fluorescence and MS detection.	2001-01-02	11225353
Copper(II) complexes with phenoxyalkanoic acids and nitrogen donor heterocyclic ligands: structure and bioactivity.	2001-01-01	11192702
BTEX catabolism interactions in a toluene-acclimatized biofilter.	2001-01	11234953
The disposition and metabolism of durene (1,2,4,5-tetramethylbenzene) in rats.	2001-01	11218043
[Physical chemical, pharmacological and toxicologic properties of fomocaine metabolites] .	2001-01	11215329
Desulfosporosinus meridiei sp. nov., a spore-forming sulfate-reducing bacterium isolated from gasolene-contaminated groundwater.	2001-01	11211250
Interfacial study of benzenesulfinate chemisorbed on silver.	2001-01	11209863
Determination of low concentrations of benzene in urine using multi-dimensional gas chromatography.	2001-01	11205510
Electric field-induced mobilisation of multiphase solution systems based on the nitration of benzene in a micro reactor.	2001-01	11205503
Solute-stationary phase interaction in gas liquid chromatography. Thermodynamic parameters for substituted halogenobenzene derivatives.	2001-01	11201225
N-nitrosoanilines: a new class of caspase-3 inhibitors.	2001-01	11197351
Triarylpyrazoles with basic side chains: development of pyrazole-based estrogen receptor antagonists.	2001-01	11197335
Comparison of binding of tetraphenylborate and tetraphenylphosphonium ions to cyclodextrins studied by capillary electrophoresis.	2001-01	11197158
Biological monitoring of workers exposed to ethylbenzene and co-exposed to xylene.	2001-01	11196078
Bioconversion of vitamin E acetate in human skin.	2001	11225197
Chemoprevention of benzene-induced bone marrow and pulmonary genotoxicity.	2001	11223895
Analysis of DNA damage using capillary zone electrophoresis and electrospray mass spectrometry.	2001	11217353

Patents

Sample Use Guides

In Vivo Use Guide

Unknown

Route of Administration: Unknown

In Vitro Use Guide

Unknown

Substance Class	Chemical Created by `admin` on `Mon Mar 31 17:35:15 GMT 2025` Edited by `admin` on `Mon Mar 31 17:35:15 GMT 2025`
Record UNII	J64922108F
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Benzene

Systematic Name

English

BENZINUM

Preferred Name

English

BENZENE [IARC]

Common Name

English

COAL NAPHTHA

Common Name

English

BENZENE [USP-RS]

Common Name

English

BIPERIDEN HYDROCHLORIDE IMPURITY F [EP IMPURITY]

Common Name

English

1,3,5-CYCLOHEXATRIENE

Systematic Name

English

BENZENE (BENZOL)

Systematic Name

English

BENZENE [MART.]

Common Name

English

BENZENE [HSDB]

Common Name

English

NCI-C55276

Common Name

English

ACETONE IMPURITY C [EP IMPURITY]

Common Name

English

NSC-67315

Code

English

CYCLOHEXATRIENE

Systematic Name

English

Benzene [WHO-DD]

Common Name

English

BENZINUM [HPUS]

Common Name

English

BENZENE [VANDF]

Common Name

English

BENZENE [MI]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C44351