1,6-DIMETHYLNAPHTHALENE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H12
Molecular Weight	156.2237
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

SMILES

CC1=CC2=CC=CC(C)=C2C=C1

InChI

InChIKey=CBMXCNPQDUJNHT-UHFFFAOYSA-N

InChI=1S/C12H12/c1-9-6-7-12-10(2)4-3-5-11(12)8-9/h3-8H,1-2H3

HIDE SMILES / InChI

Approval Year

PubMed

PubMed

Show entries

Title	Date	PubMed
Structure-activity relationships for a large diverse set of natural, synthetic, and environmental estrogens.	2001 Mar	11258977
Disposition and metabolism of 1,6-dimethylnaphthalene in rats.	2002 Aug 5	12191882
Predictive three-dimensional quantitative structure-activity relationship of cytochrome P450 1A2 inhibitors.	2005 Jun 2	15916432
Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods.	2006 Nov	16497524

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Name

Type

Language

1,6-DIMETHYLNAPHTHALENE

Systematic Name

English

1,6-DIMETHYLNAPHTHALENE [HSDB]

Common Name

English

NAPHTHALENE, 1,6-DIMETHYL-

Systematic Name

English

DIMETHYLNAPHTHALENE, 1,6-

Systematic Name

English

NSC-52966

Code

English

Showing 1 to 5 of 5 entries

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Code System

Code

Type

Description

NSC

52966

PRIMARY

CHEBI

34065

PRIMARY

EPA CompTox

DTXSID7022415

PRIMARY

CAS

575-43-9

PRIMARY

ECHA (EC/EINECS)

209-385-1

PRIMARY

Showing 1 to 5 of 8 entries

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SUBSTANCE RECORD


					DXN13WI5EY

1,6-DIMETHYLNAPHTHALENE