Hexahydro-3-(3-hydroxyphenyl)-1-methyl-2H-azepin-2-one

CAS Registry Number®

71592-44-4

CAS Name

Hexahydro-3-(3-hydroxyphenyl)-1-methyl-2H-azepin-2-one

Molecular Formula

C13H17NO2

Molecular Mass

219.28

Cite this Page

Hexahydro-3-(3-hydroxyphenyl)-1-methyl-2H-azepin-2-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=71592-44-4 (retrieved 2024-11-24) (CAS RN: 71592-44-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    192-193 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C13H17NO2/c1-14-8-3-2-7-12(13(14)16)10-5-4-6-11(15)9-10/h4-6,9,12,15H,2-3,7-8H2,1H3

InChIKey

InChIKey=IBNKFKLIUOMAQB-UHFFFAOYSA-N

SMILES

O=C1C(C2=CC(O)=CC=C2)CCCCN1C

Canonical SMILES

O=C1N(C)CCCCC1C=2C=CC=C(O)C2

Other Names for this Substance

  • 2H-Azepin-2-one, hexahydro-3-(3-hydroxyphenyl)-1-methyl-
  • Hexahydro-3-(3-hydroxyphenyl)-1-methyl-2H-azepin-2-one

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