Benzeneacetic acid, α-hydroxy-α-phenyl-, 2-(diethylamino)-1-methylethyl ester

CAS Registry Number®

57-36-3
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CAS Name

Benzeneacetic acid, α-hydroxy-α-phenyl-, 2-(diethylamino)-1-methylethyl ester

Molecular Formula

C21H27NO3

Molecular Mass

341.44

Cite this Page

Benzeneacetic acid, α-hydroxy-α-phenyl-, 2-(diethylamino)-1-methylethyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=57-36-3 (retrieved 2024-09-07) (CAS RN: 57-36-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    295 °C @ Press: 40 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C21H27NO3/c1-4-22(5-2)16-17(3)25-20(23)21(24,18-12-8-6-9-13-18)19-14-10-7-11-15-19/h6-15,17,24H,4-5,16H2,1-3H3

InChIKey

InChIKey=QTLYTFJMPQZTRQ-UHFFFAOYSA-N

SMILES

C(C(OC(CN(CC)CC)C)=O)(O)(C1=CC=CC=C1)C2=CC=CC=C2

Canonical SMILES

O=C(OC(C)CN(CC)CC)C(O)(C=1C=CC=CC1)C=2C=CC=CC2

Other Names for this Substance

  • Benzeneacetic acid, α-hydroxy-α-phenyl-, 2-(diethylamino)-1-methylethyl ester
  • Benzilic acid, 2-(diethylamino)-1-methylethyl ester
  • 2-Propanol, 1-(diethylamino)-, benzilate (ester)