NAPHTHALENE, 1,3,8-TRIMETHYL-

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C13H14
Molecular Weight	170.2503
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of NAPHTHALENE, 1,3,8-TRIMETHYL-

Structure Search

SMILES

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

InChI

InChIKey=XYTKCJHHXQVFCK-UHFFFAOYSA-N

InChI=1S/C13H14/c1-9-7-11(3)13-10(2)5-4-6-12(13)8-9/h4-8H,1-3H3

HIDE SMILES / InChI

Molecular Formula	C13H14
Molecular Weight	170.2503
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 20:02:32 GMT 2025` Edited by `admin` on `Mon Mar 31 20:02:32 GMT 2025`
Record UNII	X3MOE579W5
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

1,3,8-TRIMETHYLNAPHTHALENE

Preferred Name

English

NAPHTHALENE, 1,3,8-TRIMETHYL-

Systematic Name

English

NAPHTHALENE, TRIMETHYL-

Systematic Name

English

Code System Code Type Description

ECHA (EC/EINECS)

241-121-0

Created by admin on Mon Mar 31 20:02:33 GMT 2025 , Edited by admin on Mon Mar 31 20:02:33 GMT 2025

PRIMARY

CAS

28652-77-9

Created by admin on Mon Mar 31 20:02:33 GMT 2025 , Edited by admin on Mon Mar 31 20:02:33 GMT 2025

NON-SPECIFIC SUBSTITUTION

FDA UNII

X3MOE579W5

Created by admin on Mon Mar 31 20:02:33 GMT 2025 , Edited by admin on Mon Mar 31 20:02:33 GMT 2025

PRIMARY

EPA CompTox

DTXSID001358991

Created by admin on Mon Mar 31 20:02:33 GMT 2025 , Edited by admin on Mon Mar 31 20:02:33 GMT 2025

PRIMARY

CAS

17057-91-9

Created by admin on Mon Mar 31 20:02:33 GMT 2025 , Edited by admin on Mon Mar 31 20:02:33 GMT 2025

PRIMARY

PUBCHEM

28226

Created by admin on Mon Mar 31 20:02:33 GMT 2025 , Edited by admin on Mon Mar 31 20:02:33 GMT 2025

PRIMARY