Vitas-M small molecule compound

2,2'-tricyclo[3.3.1.1~3,7~]decane-1,3-diylbis(chloroacetic acid)

Catalog ID
STK664824
SMILES OC(=O)C(C12CC3CC(C1)CC(C2)(C3)C(C(=O)O)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 C14H18Cl2O4 MW 321.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H18Cl2O4/c15-9(11(17)18)13-2-7-1-8(4-13)5-14(3-7,6-13)10(16)12(19)20/h7-10H,1-6H2,(H,17,18)(H,19,20)
InChIKey
QHAWOQDUTATKSV-UHFFFAOYSA-N
Synonyms

2(3(carboxy(chloro)methyl)1adamantyl)2chloroaceticacid
2(3(CARBOXYCHLOROMETHYL)ADAMANTANYL)2CHLOROACETICACID
22tricyclo(3311~37~)decane13diylbis(chloroaceticacid)
2CHLORO2(3(1CHLORO2HYDROXY2OXOETHYL)1ADAMANTYL)ACETICACID
C1C2CC3(CC1CC(C2)(C3)C(C(=O)O)Cl)C(C(=O)O)Cl
InChI=1SC14H18Cl2O4c159(11(17)18)132718(413)514(37613)10(16)12(19)20h710H16H2(H1718)(H1920)
MFCD07658140
ZINC000004782579
ZINC000250662008

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Available files

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