Vitas-M small molecule compound

N-(2-chloro-9H-purin-6-yl)-beta-alanine

Catalog ID
STK711218
SMILES OC(=O)CCNc1nc(Cl)nc2c1nc[nH]2

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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 C8H8ClN5O2 MW 241.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H8ClN5O2/c9-8-13-6(10-2-1-4(15)16)5-7(14-8)12-3-11-5/h3H,1-2H2,(H,15,16)(H2,10,11,12,13,14)
InChIKey
VBNPITSJNZARMF-UHFFFAOYSA-N
Synonyms
919731-05-8
3((2chloro7Hpurin6yl)amino)propanoicacid
3((2CHLORO9HPURIN6YL)AMINO)PROPANOICACID
919731058
C1=NC2=C(N1)C(=NC(=N2)Cl)NCCC(=O)O
InChI=1SC8H8ClN5O2c98136(10214(15)16)57(148)123115h3H12H2(H1516)(H21011121314)
MFCD08743819
N(2chloro9Hpurin6yl)betaalanine
OC(=O)CCNc1nc(Cl)nc2c1nc(nH)2
ZINC000008733266
ZINC8733266

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Available files

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