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3-[(1-Cyanoethyl)amino]benzoic acid
[CAS# 70667-83-3]

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Identification
Name 3-[(1-Cyanoethyl)amino]benzoic acid
Synonyms 3-((1-cyanoethyl)amino)benzoic acid
Molecular Structure CAS#: 70667-83-3, 3-[(1-Cyanoethyl)amino]benzoic acid
Molecular Formula C10H10N2O2
Molecular Weight 190.20
CAS Registry Number 70667-83-3
SMILES CC(C#N)Nc1cccc(c1)C(=O)O
InChI 1S/C10H10N2O2/c1-7(6-11)12-9-4-2-3-8(5-9)10(13)14/h2-5,7,12H,1H3,(H,13,14)
InChIKey ABKMSVCCWDLPQS-UHFFFAOYSA-N
Properties
Density 1.283g/cm3 (Cal.)
Boiling point 447.28°C at 760 mmHg (Cal.)
Flash point 224.307°C (Cal.)
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