alpha-(Epoxyethyl)-p-methoxybenzyl alcohol

HCID 51165

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 70771-71-0
Standard SMILES: COc1ccc(C(O)C2CO2)cc1
InChIKey: NQRRYLLAQLTROY-UHFFFAOYSA-N
Molecular formula: C10H12O3
Average molar mass: 180.2 g/mol
Monoisotopic mass: 180.07864424

Names & identifiers

Preferred name: alpha-(Epoxyethyl)-p-methoxybenzyl alcohol
IUPAC: (4-methoxyphenyl)-(oxiran-2-yl)methanol

Names & synonyms

70771-71-01'-Hydroxy-estragole-2',3'-oxidealpha-(Epoxyethyl)-p-methoxybenzyl alcoholBENZYL ALCOHOL, alpha-(EPOXYETHYL)-p-METHOXY-(4-METHOXYPHENYL)(OXIRAN-2-YL)METHANOLDTXSID60991026

Database identifiers

CAS: 70771-71-0
PubChem CID: 51165
DTXSID: DTXSID60991026
Nikkaji: J66.000K

Properties

Computed structural properties

XLogP: 0.7
Topological polar surface area: 42 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 13
Formal charge: 0
Complexity: 164

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…