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Details

Stereochemistry RACEMIC
Molecular Formula C8H7BrO3
Molecular Weight 231.043
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of P-BROMOMANDELIC ACID

SMILES

OC(C(O)=O)C1=CC=C(Br)C=C1

InChI

InChIKey=BHZBRPQOYFDTAB-UHFFFAOYSA-N
InChI=1S/C8H7BrO3/c9-6-3-1-5(2-4-6)7(10)8(11)12/h1-4,7,10H,(H,11,12)

HIDE SMILES / InChI

Molecular Formula C8H7BrO3
Molecular Weight 231.043
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:42:43 GMT 2023
Edited
by admin
on Sat Dec 16 10:42:43 GMT 2023
Record UNII
4429SL694F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
P-BROMOMANDELIC ACID
MI  
Common Name English
BENZENEACETIC ACID, 4-BROMO-.ALPHA.-HYDROXY-
Common Name English
P-BROMOMANDELIC ACID, (±)-
Common Name English
DL-4-BROMOMANDELIC ACID
Common Name English
DL-P-BROMOMANDELIC ACID
Common Name English
NSC-60138
Code English
P-BROMOMANDELIC ACID [MI]
Common Name English
Code System Code Type Description
PUBCHEM
97930
Created by admin on Sat Dec 16 10:42:43 GMT 2023 , Edited by admin on Sat Dec 16 10:42:43 GMT 2023
PRIMARY
ECHA (EC/EINECS)
230-085-1
Created by admin on Sat Dec 16 10:42:43 GMT 2023 , Edited by admin on Sat Dec 16 10:42:43 GMT 2023
PRIMARY
NSC
60138
Created by admin on Sat Dec 16 10:42:43 GMT 2023 , Edited by admin on Sat Dec 16 10:42:43 GMT 2023
PRIMARY
EPA CompTox
DTXSID40871938
Created by admin on Sat Dec 16 10:42:43 GMT 2023 , Edited by admin on Sat Dec 16 10:42:43 GMT 2023
PRIMARY
CAS
6940-50-7
Created by admin on Sat Dec 16 10:42:43 GMT 2023 , Edited by admin on Sat Dec 16 10:42:43 GMT 2023
PRIMARY
MERCK INDEX
m2704
Created by admin on Sat Dec 16 10:42:43 GMT 2023 , Edited by admin on Sat Dec 16 10:42:43 GMT 2023
PRIMARY Merck Index
FDA UNII
4429SL694F
Created by admin on Sat Dec 16 10:42:43 GMT 2023 , Edited by admin on Sat Dec 16 10:42:43 GMT 2023
PRIMARY