4-(Hydroxymethyl)-8,8-dimethyl-3-methylideneoctahydro-3a,7-ethanoinden-2-ol

HCID 185064

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Basic information

CAS: 90996-29-5
Standard SMILES: C=C1[C@H](O)C[C@@H]2[C@@H]3CC[C@@H](CO)C12CC3(C)C
InChIKey: OWLXDZIREIBTII-OPJHEWCBSA-N
Molecular formula: C15H24O2
Average molar mass: 236.35 g/mol
Monoisotopic mass: 236.17763

Names & identifiers

Preferred name: 4-(Hydroxymethyl)-8,8-dimethyl-3-methylideneoctahydro-3a,7-ethanoinden-2-ol
IUPAC: (3R,5R,6S,9R)-9-(hydroxymethyl)-11,11-dimethyl-2-methylidenetricyclo[4.3.2.01,5]undecan-3-ol

Names & synonyms

DTXSID209200144-(Hydroxymethyl)-8,8-dimethyl-3-methylideneoctahydro-3a,7-ethanoinden-2-ol(2R,4R,7S,7aR)-4-(Hydroxymethyl)-8,8-dimethyl-3-methylideneoctahydro-3a,7-ethanoinden-2-ol

Database identifiers

CAS: 90996-29-5
PubChem CID: 185064
DTXSID: DTXSID20920014

Properties

Computed structural properties

XLogP: 2.3
Topological polar surface area: 40.5 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 17
Formal charge: 0
Complexity: 360

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