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Details

Stereochemistry ACHIRAL
Molecular Formula C8H7BrO3
Molecular Weight 231.043
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-BROMO-P-ANISIC ACID

SMILES

COC1=C(Br)C=C(C=C1)C(O)=O

InChI

InChIKey=BBPZABXVRBFWGD-UHFFFAOYSA-N
InChI=1S/C8H7BrO3/c1-12-7-3-2-5(8(10)11)4-6(7)9/h2-4H,1H3,(H,10,11)

HIDE SMILES / InChI

Molecular Formula C8H7BrO3
Molecular Weight 231.043
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 Sat Dec 16 12:17:01 GMT 2023
Edited
by admin
on Sat Dec 16 12:17:01 GMT 2023
Record UNII
F82QV9Q9FX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-BROMO-P-ANISIC ACID
Systematic Name English
BENZOIC ACID, 3-BROMO-4-METHOXY-
Systematic Name English
P-ANISIC ACID, 3-BROMO-
Systematic Name English
3-BROMO-4-METHOXYBENZOIC ACID
Systematic Name English
Code System Code Type Description
FDA UNII
F82QV9Q9FX
Created by admin on Sat Dec 16 12:17:01 GMT 2023 , Edited by admin on Sat Dec 16 12:17:01 GMT 2023
PRIMARY
CAS
99-58-1
Created by admin on Sat Dec 16 12:17:01 GMT 2023 , Edited by admin on Sat Dec 16 12:17:01 GMT 2023
PRIMARY
ECHA (EC/EINECS)
202-768-4
Created by admin on Sat Dec 16 12:17:01 GMT 2023 , Edited by admin on Sat Dec 16 12:17:01 GMT 2023
PRIMARY
PUBCHEM
66836
Created by admin on Sat Dec 16 12:17:01 GMT 2023 , Edited by admin on Sat Dec 16 12:17:01 GMT 2023
PRIMARY
EPA CompTox
DTXSID00243930
Created by admin on Sat Dec 16 12:17:01 GMT 2023 , Edited by admin on Sat Dec 16 12:17:01 GMT 2023
PRIMARY