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Home > Encyclopedia > β-Amino-3-nitrobenzenepropanoic acid

β-Amino-3-nitrobenzenepropanoic acid

β-Amino-3-nitrobenzenepropanoic acid structure

β-Amino-3-nitrobenzenepropanoic acid 

structure
  • CAS No:

    5678-47-7

  • Formula:

    C9H10N2O4

  • Chemical Name:

    β-Amino-3-nitrobenzenepropanoic acid

  • Synonyms:

    Benzenepropanoic acid,β-amino-3-nitro-;Hydrocinnamic acid,β-amino-m-nitro-;β-Amino-3-nitrobenzenepropanoic acid;NSC 40724;3-Amino-3-(3-nitrophenyl)propanoic acid;3-Amino-3-(3-nitro-phenyl)-propionic acid

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

β-Amino-3-nitrobenzenepropanoic acid Basic Attributes

210.19

210.19

40724

DTXSID80285156

2922499990

Characteristics

109

0.64

1.4±0.1 g/cm3

230 °C (decomp)

384.5±37.0 °C at 760 mmHg

186.4±26.5 °C

1.613

Safety Information

IRRITANT

Computed Properties

Molecular Weight:210.19
XLogP3:-2.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:210.06405680
Monoisotopic Mass:210.06405680
Topological Polar Surface Area:109
Heavy Atom Count:15
Complexity:251
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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