Vitas-M small molecule compound

N-[(3-bromophenyl)carbonyl]-beta-alanine

Catalog ID
STK980582
SMILES OC(=O)CCNC(=O)c1cccc(c1)Br

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C10H10BrNO3 MW 272.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H10BrNO3/c11-8-3-1-2-7(6-8)10(15)12-5-4-9(13)14/h1-3,6H,4-5H2,(H,12,15)(H,13,14)
InChIKey
XXYNGCYDCHRAPU-UHFFFAOYSA-N
Synonyms
333394-85-7
3((3bromobenzoyl)amino)propanoicacid
3((3BROMOPHENYL)CARBONYLAMINO)PROPANOICACID
3((3BROMOPHENYL)FORMAMIDO)PROPANOICACID
333394857
C1=CC(=CC(=C1)Br)C(=O)NCCC(=O)O
InChI=1SC10H10BrNO3c1183127(68)10(15)12549(13)14h136H45H2(H1215)(H1314)
MFCD01009658
N((3bromophenyl)carbonyl)betaalanine
N(3BROMOBENZOYL)BETAALANINE
ZINC000005427987
ZINC5427987

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.