Vitas-M small molecule compound
1,4,5,6,7,7-hexachloro-3-[(2-chloro-4,6-dimethylphenyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Catalog ID
STK330799
SMILES Cc1cc(C)c(c(c1)Cl)NC(=O)C1C(C(=O)O)C2(C(C1(Cl)C(=C2Cl)Cl)(Cl)Cl)Cl
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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 C17H12Cl7NO3 MW 526.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12Cl7NO3/c1-5-3-6(2)10(7(18)4-5)25-13(26)8-9(14(27)28)16(22)12(20)11(19)15(8,21)17(16,23)24/h3-4,8-9H,1-2H3,(H,25,26)(H,27,28)InChIKey
MRWKEMTXWDPSJD-UHFFFAOYSA-NSynonyms
123477hexachloro6((2chloro46dimethylphenyl)carbamoyl)bicyclo(221)hept2ene5carboxylicacid
145677hexachloro3((2chloro46dimethylphenyl)carbamoyl)bicyclo(221)hept5ene2carboxylicacid
CC1=CC(=C(C(=C1)Cl)NC(=O)C2C(C3(C(=C(C2(C3(Cl)Cl)Cl)Cl)Cl)Cl)C(=O)O)C
InChI=1SC17H12Cl7NO3c1536(2)10(7(18)45)2513(26)89(14(27)28)16(22)12(20)11(19)15(821)17(1623)24h3489H12H3(H2526)(H2728)
MFCD01175742
ZINC000226773875
ZINC000226773900
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