1-Methylethyl β-aminobenzenepropanoate

CAS Registry Number®

100369-82-2
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CAS Name

1-Methylethyl β-aminobenzenepropanoate

Molecular Formula

C12H17NO2

Molecular Mass

207.27

Cite this Page

1-Methylethyl β-aminobenzenepropanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=100369-82-2 (retrieved 2024-05-05) (CAS RN: 100369-82-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    148-149 °C @ Press: 13 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H17NO2/c1-9(2)15-12(14)8-11(13)10-6-4-3-5-7-10/h3-7,9,11H,8,13H2,1-2H3

InChIKey

InChIKey=VJZAAPSRRTVRQL-UHFFFAOYSA-N

SMILES

C(CC(OC(C)C)=O)(N)C1=CC=CC=C1

Canonical SMILES

O=C(OC(C)C)CC(N)C=1C=CC=CC1

Other Names for this Substance

  • Benzenepropanoic acid, β-amino-, 1-methylethyl ester
  • Hydrocinnamic acid, β-amino-, isopropyl ester
  • 1-Methylethyl β-aminobenzenepropanoate
  • Isopropyl 3-amino-3-phenylpropionate

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