1,1-Dimethylethyl N-[(2R,3S)-2-(2,5-difluorophenyl)tetrahydro-5-oxo-2H-pyran-3-yl]carbamate

CAS Registry Number®

951127-25-6
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CAS Name

1,1-Dimethylethyl N-[(2R,3S)-2-(2,5-difluorophenyl)tetrahydro-5-oxo-2H-pyran-3-yl]carbamate

Molecular Formula

C16H19F2NO4

Molecular Mass

327.32

Cite this Page

1,1-Dimethylethyl N-[(2R,3S)-2-(2,5-difluorophenyl)tetrahydro-5-oxo-2H-pyran-3-yl]carbamate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=951127-25-6 (retrieved 2024-07-02) (CAS RN: 951127-25-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    158-160 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C16H19F2NO4/c1-16(2,3)23-15(21)19-13-7-10(20)8-22-14(13)11-6-9(17)4-5-12(11)18/h4-6,13-14H,7-8H2,1-3H3,(H,19,21)/t13-,14+/m0/s1

InChIKey

InChIKey=OTCULXVRRSCLLI-UONOGXRCSA-N

SMILES

N(C(OC(C)(C)C)=O)[C@@H]1[C@H](OCC(=O)C1)C2=C(F)C=CC(F)=C2

Canonical SMILES

O=C(OC(C)(C)C)NC1CC(=O)COC1C2=CC(F)=CC=C2F

Other Names for this Substance

  • Carbamic acid, N-[(2R,3S)-2-(2,5-difluorophenyl)tetrahydro-5-oxo-2H-pyran-3-yl]-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl N-[(2R,3S)-2-(2,5-difluorophenyl)tetrahydro-5-oxo-2H-pyran-3-yl]carbamate