β-Aminobenzenebutanoic acid
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β-Aminobenzenebutanoic acid
structure -
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CAS No:
15099-85-1
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Formula:
C10H13NO2
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Chemical Name:
β-Aminobenzenebutanoic acid
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Synonyms:
Benzenebutanoic acid,β-amino-;β-Aminobenzenebutanoic acid;3-Benzyl-β-alanine;NSC 127002;NSC 127018;3-Amino-4-phenylbutanoic acid;131725-48-9
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CAS No:
Description
DL-beta-Homophenylalanine is an organooxygen compound and an organonitrogen compound. It derives from a beta-amino acid.
β-Aminobenzenebutanoic acid Basic Attributes
179.22
179.22
200-568-1
127002
DTXSID70298932
2922499990
Characteristics
63.3
-1.5
powder
1.2±0.1 g/cm3
226 °C @ Solvent: Water, Ethanol, Diethyl ether
329.5°C at 760 mmHg
153.1±24.6 °C
1.565
H2O: 0.1 M at 20 °C, clear, colorless
Computed Properties
Molecular Weight:179.22
XLogP3:-1.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:179.094628657
Monoisotopic Mass:179.094628657
Topological Polar Surface Area:63.3
Heavy Atom Count:13
Complexity:164
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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