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Details

Stereochemistry ACHIRAL
Molecular Formula C6H3Br3
Molecular Weight 314.8
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,2,4-TRIBROMOBENZENE

SMILES

BrC1=CC(Br)=C(Br)C=C1

InChI

InChIKey=FWAJPSIPOULHHH-UHFFFAOYSA-N
InChI=1S/C6H3Br3/c7-4-1-2-5(8)6(9)3-4/h1-3H

HIDE SMILES / InChI

Molecular Formula C6H3Br3
Molecular Weight 314.8
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Hepatotoxicity of brominated benzenes: relationship between chemical structure and hepatotoxic effects in acute intoxication of mice.
1998
Calculation of the A term of magnetic circular dichroism based on time dependent-density functional theory I. Formulation and implementation.
2004 Jun 15
Substance Class Chemical
Created
by admin
on Sat Dec 16 08:26:08 GMT 2023
Edited
by admin
on Sat Dec 16 08:26:08 GMT 2023
Record UNII
EOE1KFC260
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,2,4-TRIBROMOBENZENE
Systematic Name English
NSC-62440
Code English
BENZENE, 1,2,4-TRIBROMO-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID5024346
Created by admin on Sat Dec 16 08:26:08 GMT 2023 , Edited by admin on Sat Dec 16 08:26:08 GMT 2023
PRIMARY
ECHA (EC/EINECS)
210-433-9
Created by admin on Sat Dec 16 08:26:08 GMT 2023 , Edited by admin on Sat Dec 16 08:26:08 GMT 2023
PRIMARY
PUBCHEM
12002
Created by admin on Sat Dec 16 08:26:08 GMT 2023 , Edited by admin on Sat Dec 16 08:26:08 GMT 2023
PRIMARY
CAS
615-54-3
Created by admin on Sat Dec 16 08:26:08 GMT 2023 , Edited by admin on Sat Dec 16 08:26:08 GMT 2023
PRIMARY
FDA UNII
EOE1KFC260
Created by admin on Sat Dec 16 08:26:08 GMT 2023 , Edited by admin on Sat Dec 16 08:26:08 GMT 2023
PRIMARY
NSC
62440
Created by admin on Sat Dec 16 08:26:08 GMT 2023 , Edited by admin on Sat Dec 16 08:26:08 GMT 2023
PRIMARY