Benzoic acid, 3,5-diamino-, ethyl ester

CAS Registry Number®

1949-51-5
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CAS Name

Benzoic acid, 3,5-diamino-, ethyl ester

Molecular Formula

C9H12N2O2

Molecular Mass

180.20

Cite this Page

Benzoic acid, 3,5-diamino-, ethyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1949-51-5 (retrieved 2024-08-11) (CAS RN: 1949-51-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    84 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H12N2O2/c1-2-13-9(12)6-3-7(10)5-8(11)4-6/h3-5H,2,10-11H2,1H3

InChIKey

InChIKey=IDLVQOMJOKNXSL-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(OCC)C=1C=C(N)C=C(N)C1

Other Names for this Substance

  • Benzoic acid, 3,5-diamino-, ethyl ester
  • 3,5-Diaminobenzoic acid, ethyl ester
  • Ethyl 3,5-diaminobenzoate
  • Naretin