U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C12H16BrNO
Molecular Weight 270.166
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-BROMO-3,3-DIMETHYL-N-PHENYLBUTANAMIDE

SMILES

CC(C)(C)C(Br)C(=O)NC1=CC=CC=C1

InChI

InChIKey=FCBRNMLTKNGVTL-UHFFFAOYSA-N
InChI=1S/C12H16BrNO/c1-12(2,3)10(13)11(15)14-9-7-5-4-6-8-9/h4-8,10H,1-3H3,(H,14,15)

HIDE SMILES / InChI

Molecular Formula C12H16BrNO
Molecular Weight 270.166
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 08:50:44 GMT 2023
Edited
by admin
on Sat Dec 16 08:50:44 GMT 2023
Record UNII
LC9S59Z9BV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-BROMO-3,3-DIMETHYL-N-PHENYLBUTANAMIDE
Systematic Name English
BUTANAMIDE, 2-BROMO-3,3-DIMETHYL-N-PHENYL-
Systematic Name English
NSC-1170
Code English
Code System Code Type Description
EPA CompTox
DTXSID501023341
Created by admin on Sat Dec 16 08:50:44 GMT 2023 , Edited by admin on Sat Dec 16 08:50:44 GMT 2023
PRIMARY
CAS
5344-87-6
Created by admin on Sat Dec 16 08:50:44 GMT 2023 , Edited by admin on Sat Dec 16 08:50:44 GMT 2023
PRIMARY
PUBCHEM
95312
Created by admin on Sat Dec 16 08:50:44 GMT 2023 , Edited by admin on Sat Dec 16 08:50:44 GMT 2023
PRIMARY
FDA UNII
LC9S59Z9BV
Created by admin on Sat Dec 16 08:50:44 GMT 2023 , Edited by admin on Sat Dec 16 08:50:44 GMT 2023
PRIMARY
NSC
1170
Created by admin on Sat Dec 16 08:50:44 GMT 2023 , Edited by admin on Sat Dec 16 08:50:44 GMT 2023
PRIMARY