Chem
J-GLOBAL ID：200907062869920814
Nikkaji number：J2.667.023C
(3R)-3-(4-Methoxyphenoxy)-3-phenylpropane-1-ol
(3R)-3-(4-メトキシフェノキシ)-3-フェニルプロパン-1-オール
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C16H18O3
Molecular formula furigana： C16-H18-O3
Molecular weight： 258.317
InChI：
InChI=1S/C16H18O3/c1-18-14-7-9-15(10-8-14)19-16(11-12-17)13-5-3-2-4-6-13/h2-10,16-17H,11-12H2,1H3/t16-/m1/s1
InChI key：
SHHXUSTVKAPSSD-MRXNPFEDSA-N
SMILES：
COc1ccc(O[C@H](CCO)c2ccccc2)cc1
Systematic name (2)：
- (3R)-3-(4-メトキシフェノキシ)-3-フェニルプロパン-1-オール
- (3R)-3-(4-methoxyphenoxy)-3-phenylpropan-1-ol
- (3R)-3-(4-Methoxyphenoxy)-3-phenylpropane-1-ol
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