5-(Benzyloxy)-2,3-dihydro-1h-inden-1-ol

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Basic information

CAS: 3199-73-3
Standard SMILES: OC1CCc2cc(OCc3ccccc3)ccc21
InChIKey: YWZOVDJXPCLYQD-UHFFFAOYSA-N
Molecular formula: C16H16O2
Average molar mass: 240.3 g/mol
Monoisotopic mass: 240.11502975

Names & identifiers

Preferred name: 5-(Benzyloxy)-2,3-dihydro-1h-inden-1-ol
IUPAC: 5-phenylmethoxy-2,3-dihydro-1H-inden-1-ol

Names & synonyms

3199-73-35-(benzyloxy)-2,3-dihydro-1h-inden-1-ol1H-Inden-1-ol,2,3-dihydro-5-(phenylmethoxy)-NSC80573SCHEMBL1746466DTXSID70292157YWZOVDJXPCLYQD-UHFFFAOYSA-NNSC-805732,3-Dihydro-5-(phenylmethoxy)-1H-inden-1-ol

Database identifiers

CAS: 3199-73-3
PubChem CID: 255228
DTXSID: DTXSID70292157

Properties

Computed structural properties

XLogP: 2.9
Topological polar surface area: 29.5 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 3
Heavy atoms: 18
Formal charge: 0
Complexity: 260

Related reactions

3 records

New reaction record

HRID 310886As productTraining data from https://doi.org/10.1039/C8SC04228D (8/10)

HRID 1678572As productuspto-grants-2011_08

HRID 2422207As productuspto-grants-2011_06

Compound notes

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