Vitas-M small molecule compound
2-chloroprop-2-en-1-yl 2-methylbut-3-yn-2-yl bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate
Catalog ID
STK074436
SMILES C#CC(OC(=O)C1C2C=CC(C1C(=O)OCC(=C)Cl)C2)(C)C
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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 C17H19ClO4 MW 322.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19ClO4/c1-5-17(3,4)22-16(20)14-12-7-6-11(8-12)13(14)15(19)21-9-10(2)18/h1,6-7,11-14H,2,8-9H2,3-4H3InChIKey
FPSHTZYXFHJOHF-UHFFFAOYSA-NSynonyms
(1S2R4R)2(2chloroallyl)3(2methylbut3yn2yl)bicyclo(221)hept5ene23dicarboxylate
11DIMETHYLPROP2YNYL3((2CHLOROPROP2ENYL)OXYCARBONYL)BICYCLO(221)HEPT5ENE2CARBOXYLATE
2(2CHLORO2PROPENYL)3(11DIMETHYL2PROPYNYL)BICYCLO(221)HEPT5ENE23DICARBOXYLATE
2CHLOROPROP2EN1YL2METHYLBUT3YN2YL(1R2R3R4R)BICYCLO(221)HEPT5ENE23DICARBOXYLATE
2CHLOROPROP2EN1YL2METHYLBUT3YN2YL(1S2S3S4S)BICYCLO(221)HEPT5ENE23DICARBOXYLATE
2CHLOROPROP2EN1YL2METHYLBUT3YN2YLBICYCLO(221)HEPT5ENE23DICARBOXYLATE
2O(2CHLOROPROP2ENYL)3O(2METHYLBUT3YN2YL)BICYCLO(221)HEPT5ENE23DICARBOXYLATE
C#CC(OC(=O)C1C2C=CC((C@@H)1C(=O)OCC(=C)Cl)C2)(C)C
C#CC(OC(=O)C1C2C=CC(C1C(=O)OCC(=C)Cl)C2)(C)C
CC(C)(C#C)OC(=O)C1C2CC(C1C(=O)OCC(=C)Cl)C=C2
InChI=1SC17H19ClO4c1517(34)2216(20)14127611(812)13(14)15(19)21910(2)18h1671114H289H234H3
MFCD01871147
STK074436
ZINC000100006760
ZINC000239046373
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