Agn-PC-0mxnjn

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Basic information

CAS: 165072-41-3
Standard SMILES: COc1ccc2c(c1)C(O)C(C)(C)C2
InChIKey: SFMNWJYYJUYIIW-UHFFFAOYSA-N
Molecular formula: C12H16O2
Average molar mass: 192.25 g/mol
Monoisotopic mass: 192.11502975

Names & identifiers

Preferred name: Agn-PC-0mxnjn
IUPAC: 6-methoxy-2,2-dimethyl-1,3-dihydroinden-1-ol
English name: 2,3-Dihydro-2,2-dimethyl-6-methoxy-1H-inden-1-ol
Molecular formula: C12H16O2
Molecular weight: 192.25

Names & synonyms

165072-41-3AGN-PC-0MXNJNDTXSID40434481RefChem:317672DTXCID803853076-methoxy-2,2-dimethyl-1,3-dihydroinden-1-ol2,3-DIHYDRO-2,2-DIMETHYL-6-METHOXY-1H-INDEN-1-OLAKOS0063059186-Methoxy-2,2-dimethyl-2,3-dihydro-1H-inden-1-ol1H-Inden-1-ol, 2,3-dihydro-6-methoxy-2,2-dimethyl-

Database identifiers

CAS: 165072-41-3
PubChem CID: 10035482
DTXSID: DTXSID40434481

Properties

Computed structural properties

XLogP: 2.3
Topological polar surface area: 29.5 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 14
Formal charge: 0
Complexity: 212

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Compound notes

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