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3-(Isobutyrylamino)Benzoic Acid
[CAS# 28533-44-0]

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Identification
Name 3-(Isobutyrylamino)Benzoic Acid
Synonyms 3-(2-methylpropanoylamino)benzoic acid; 3-[(2-methylpropanoyl)amino]benzoic acid; AO-548/40055117
Molecular Structure CAS#: 28533-44-0, 3-(Isobutyrylamino)Benzoic Acid
Molecular Formula C11H13NO3
Molecular Weight 207.23
CAS Registry Number 28533-44-0
SMILES O=C(Nc1cc(ccc1)C(=O)O)C(C)C
InChI 1S/C11H13NO3/c1-7(2)10(13)12-9-5-3-4-8(6-9)11(14)15/h3-7H,1-2H3,(H,12,13)(H,14,15)
InChIKey OXGBTVAWGOSFIX-UHFFFAOYSA-N
Properties
Density 1.23g/cm3 (Cal.)
Boiling point 438.941°C at 760 mmHg (Cal.)
Flash point 219.264°C (Cal.)
Refractive index 1.588 (Cal.)
Safety Data
Safety Description IRRITANT
SDS Available
Market Analysis Reports
List of Reports Available for 3-(Isobutyrylamino)Benzoic Acid
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