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alpha-(Butylamino)-Benzeneacetic Acid
[CAS# 5472-06-0]

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Identification
Name alpha-(Butylamino)-Benzeneacetic Acid
Synonyms 2-Butylamino-2-Phenyl-Acetic Acid; 2-Butylamino-2-Phenyl-Ethanoic Acid; Nsc24611
Molecular Structure CAS#: 5472-06-0, alpha-(Butylamino)-Benzeneacetic Acid
Molecular Formula C12H17NO2
Molecular Weight 207.27
CAS Registry Number 5472-06-0
SMILES C1=CC=CC=C1C(NCCCC)C(=O)O
InChI 1S/C12H17NO2/c1-2-3-9-13-11(12(14)15)10-7-5-4-6-8-10/h4-8,11,13H,2-3,9H2,1H3,(H,14,15)
InChIKey HHBSIIRCNFRFSW-UHFFFAOYSA-N
Properties
Density 1.077g/cm3 (Cal.)
Boiling point 321.312°C at 760 mmHg (Cal.)
Flash point 148.124°C (Cal.)
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