1,2-DIETHYLBENZENE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H14
Molecular Weight	134.2182
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

SMILES

CCC1=C(CC)C=CC=C1

InChI

InChIKey=KVNYFPKFSJIPBJ-UHFFFAOYSA-N

InChI=1S/C10H14/c1-3-9-7-5-6-8-10(9)4-2/h5-8H,3-4H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C10H14
Molecular Weight	134.2182
Charge	0
Count	MOL RATIO 1 MOL RATIO (average)

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

Approval Year

PubMed

PubMed

Show entries

Title	Date	PubMed
1,2-diacetylbenzene, the neurotoxic metabolite of a chromogenic aromatic solvent, induces proximal axonopathy.	2001 Dec 1	11740911
Toxicokinetics and metabolism of 1,2-diethylbenzene in male Sprague Dawley rats--part 2: evidence for in vitro and in vivo stereoselectivity of 1,2-diethylbenzene metabolism.	2001 Jun	11353756
Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods.	2006 Nov	16497524
Nanoporous organosilicas as preconcentration materials for the electrochemical detection of trinitrotoluene.	2008 Jun 15	18470994
Probing mechanisms of axonopathy. Part I: Protein targets of 1,2-diacetylbenzene, the neurotoxic metabolite of aromatic solvent 1,2-diethylbenzene.	2008 Sep	18502740

Showing 1 to 5 of 8 entries

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Substance Class	Chemical
Record UNII	25HOX6T1LU
Record Status	`Validated (UNII)`
Record Version

Show entries

Name

Type

Language

1,2-DIETHYLBENZENE

Systematic Name

English

BENZENE, O-DIETHYL-

Common Name

English

BENZENE, 1,2-DIETHYL-

Systematic Name

English

1,2-DIETHYLBENZENE [HSDB]

Common Name

English

O-DIETHYLBENZENE

Common Name

English

Showing 1 to 5 of 5 entries

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Code System

Code

Type

Description

FDA UNII

25HOX6T1LU

PRIMARY

EPA CompTox

DTXSID6052742

PRIMARY

PUBCHEM

8657

PRIMARY

ECHA (EC/EINECS)

205-170-1

PRIMARY

MESH

C064750

PRIMARY

Showing 1 to 5 of 7 entries

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