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Details

Stereochemistry ACHIRAL
Molecular Formula C20H15Br
Molecular Weight 335.237
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 12-Bromomethyl-7-methylbenz[a]anthracene

SMILES

CC1=C2C=CC3=C(C=CC=C3)C2=C(CBr)C4=CC=CC=C14

InChI

InChIKey=CIJKQWCEYOGOJP-UHFFFAOYSA-N
InChI=1S/C20H15Br/c1-13-15-7-4-5-9-18(15)19(12-21)20-16(13)11-10-14-6-2-3-8-17(14)20/h2-11H,12H2,1H3

HIDE SMILES / InChI

Molecular Formula C20H15Br
Molecular Weight 335.237
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 22:07:44 GMT 2025
Edited
by admin
on Mon Mar 31 22:07:44 GMT 2025
Record UNII
8R8CZS8NFK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
12-Bromomethyl-7-methylbenz[a]anthracene
Systematic Name English
12-(Bromomethyl)-7-methylbenz[a]anthracene
Preferred Name English
Benz[a]anthracene, 12-(bromomethyl)-7-methyl-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID40207975
Created by admin on Mon Mar 31 22:07:44 GMT 2025 , Edited by admin on Mon Mar 31 22:07:44 GMT 2025
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FDA UNII
8R8CZS8NFK
Created by admin on Mon Mar 31 22:07:44 GMT 2025 , Edited by admin on Mon Mar 31 22:07:44 GMT 2025
PRIMARY
CAS
59230-81-8
Created by admin on Mon Mar 31 22:07:44 GMT 2025 , Edited by admin on Mon Mar 31 22:07:44 GMT 2025
PRIMARY
PUBCHEM
42983
Created by admin on Mon Mar 31 22:07:44 GMT 2025 , Edited by admin on Mon Mar 31 22:07:44 GMT 2025
PRIMARY