Vitas-M small molecule compound
1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazole-3-carboxylic acid
Catalog ID
STK392453
SMILES OC(=O)c1n[nH]c2c1CCCCC2
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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 C9H12N2O2 MW 180.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H12N2O2/c12-9(13)8-6-4-2-1-3-5-7(6)10-11-8/h1-5H2,(H,10,11)(H,12,13)InChIKey
NFNLJMOKEMQHAB-UHFFFAOYSA-NSynonyms
856256-63-8145678hexahydrocyclohepta(c)pyrazole3carboxylicacid
1H4H5H6H7H8HCYCLOHEPTA(C)PYRAZOLE3CARBOXYLICACID
2H4H5H6H7H8HCYCLOHEPTA(C)PYRAZOLE3CARBOXYLICACID
856256638
C1CCC2=C(CC1)NN=C2C(=O)O
InChI=1SC9H12N2O2c129(13)86421357(6)10118h15H2(H1011)(H1213)
MFCD06740820
OC(=O)c1n(nH)c2c1CCCCC2
ZINC000005052891
ZINC5052891
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