Chem
J-GLOBAL ID:200907048682868891   Nikkaji number:J579.413G

(R)-3,3,3-Trifluoro-2-methoxy-2-phenylpropanoic acid (S)-6,6-dimethyl-5-oxo-3-phenylheptyl ester

(R)-3,3,3-トリフルオロ-2-メトキシ-2-フェニルプロパン酸(S)-6,6-ジメチル-5-オキソ-3-フェニルヘプチル
Substance type:
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
Molecular formula: C25H29F3O4
Molecular formula furigana: C25-H29-F3-O4
Molecular weight: 450.498
InChI: InChI=1S/C25H29F3O4/c1-23(2,3)21(29)17-19(18-11-7-5-8-12-18)15-16-32-22(30)24(31-4,25(26,27)28)20-13-9-6-10-14-20/h5-14,19H,15-17H2,1-4H3/t19-,24+/m0/s1
InChI key: BZSFBNVTQJKHGI-YADARESESA-N
SMILES: CO[C@@](C(=O)OCC[C@@H](CC(=O)C(C)(C)C)c1ccccc1)(c1ccccc1)C(F)(F)F
Systematic name  (3):
  • (R)-3,3,3-トリフルオロ-2-メトキシ-2-フェニルプロパン酸(S)-6,6-ジメチル-5-オキソ-3-フェニルヘプチル
  • (3S)-6,6-ジメチル-5-オキソ-3-フェニルヘプチル (2R)-3,3,3-トリフルオロ-2-メトキシ-2-フェニルプロパノアート
  • (3S)-6,6-dimethyl-5-oxo-3-phenylheptyl (2R)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoate
Other name (1):
  • (R)-3,3,3-Trifluoro-2-methoxy-2-phenylpropanoic acid (S)-6,6-dimethyl-5-oxo-3-phenylheptyl ester
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