Products 171015-31-9

CAS 171015-31-9 is the registry number for Calcitriol Impurity 8. Offered by: Chemat Brand. Available pack sizes: on request.

Calcitriol Impurity 8
Chemat Brand
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Structural formula: {0} (CAS {1})

(1R,3aR,4S,7aR)-7a-methyl-1-prop-1-en-2-yl-1,2,3,3a,4,5,6,7-octahydroinden-4-ol (CAS 171015-31-9) is a chemical compound with the molecular formula C13H22O and a molecular weight of 194.31 g/mol. IUPAC name: (1R,3aR,4S,7aR)-7a-methyl-1-prop-1-en-2-yl-1,2,3,3a,4,5,6,7-octahydroinden-4-ol. InChIKey: AGHJOAJPHUGGRC-MROQNXINSA-N.

Identity
Molecular formulaC13H22O
Molecular weight194.31 g/mol
IUPAC name(1R,3aR,4S,7aR)-7a-methyl-1-prop-1-en-2-yl-1,2,3,3a,4,5,6,7-octahydroinden-4-ol
InChIKeyAGHJOAJPHUGGRC-MROQNXINSA-N
SMILESCC(=C)[C@H]1CC[C@@H]2[C@@]1(CCC[C@@H]2O)C

Computed by PubChem (NCBI)

Isomers (same molecular formula)
4-(4-methylcyclohexyl)cyclohexan-1-one C13H22O
2-propan-2-yladamantan-2-ol C13H22O
3,5,7-trimethyladamantan-1-ol C13H22O
dicyclohexylmethanone C13H22O
(3,5-dimethyl-1-adamantyl)methanol C13H22O
2-(1-adamantyl)propan-2-ol C13H22O
1-(1-adamantyl)propan-2-ol C13H22O
(1E)-cyclododecene-1-carbaldehyde C13H22O
(2S,5S)-2,6,6,10-tetramethyl-1-oxaspiro[4.5]dec-9-ene C13H22O
(6E)-8-methyl-5-propan-2-ylnona-6,8-dien-2-one C13H22O
2,6,6,10-tetramethyl-1-oxaspiro[4.5]dec-9-ene C13H22O
2-propyladamantan-2-ol C13H22O