3,3-Dimethyl-1-(1-imidazolyl)-1-phenyl-5-hexen-2-ol

HCID 20065635
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Basic information

Standard SMILES
C=CCC(C)(C)C(O)C(c1ccccc1)n1ccnc1
InChIKey
VSBIXVRILPGSTP-UHFFFAOYSA-N
Molecular formula
C17H22N2O
Average molar mass
270.37 g/mol
Monoisotopic mass
270.17321333

Names & identifiers

Preferred name
3,3-Dimethyl-1-(1-imidazolyl)-1-phenyl-5-hexen-2-ol
IUPAC
1-imidazol-1-yl-3,3-dimethyl-1-phenylhex-5-en-2-ol

Names & synonyms

SCHEMBL9663665VSBIXVRILPGSTP-UHFFFAOYSA-N3,3-dimethyl-1-(1-imidazolyl)-1-phenyl-5-hexen-2-ol

Database identifiers

PubChem CID
20065635

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
38.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
6
Heavy atoms
20

Related reactions

2 records
New reaction record

Compound notes

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