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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 1,2,3-Trimethylnaphthalene

SMILES

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

InChI

InChIKey=RQHPYGROUIBUSW-UHFFFAOYSA-N
InChI=1S/C13H14/c1-9-8-12-6-4-5-7-13(12)11(3)10(9)2/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 Tue Apr 01 19:09:55 GMT 2025
Edited
by admin
on Tue Apr 01 19:09:55 GMT 2025
Record UNII
QH7X7QUT4Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,2,3-Trimethylnaphthalene
Systematic Name English
Naphthalene, 1,2,3-trimethyl-
Preferred Name English
Code System Code Type Description
CAS
879-12-9
Created by admin on Tue Apr 01 19:09:55 GMT 2025 , Edited by admin on Tue Apr 01 19:09:55 GMT 2025
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PUBCHEM
70145
Created by admin on Tue Apr 01 19:09:55 GMT 2025 , Edited by admin on Tue Apr 01 19:09:55 GMT 2025
PRIMARY
ECHA (EC/EINECS)
212-902-3
Created by admin on Tue Apr 01 19:09:55 GMT 2025 , Edited by admin on Tue Apr 01 19:09:55 GMT 2025
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FDA UNII
QH7X7QUT4Z
Created by admin on Tue Apr 01 19:09:55 GMT 2025 , Edited by admin on Tue Apr 01 19:09:55 GMT 2025
PRIMARY
EPA CompTox
DTXSID00236685
Created by admin on Tue Apr 01 19:09:55 GMT 2025 , Edited by admin on Tue Apr 01 19:09:55 GMT 2025
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