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Home >> Chemical Listing >> Page 2288 >> 3-Amino-4-(1-azepanyl)benzoic acid

3-Amino-4-(1-azepanyl)benzoic acid
[CAS# 693805-72-0]

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Identification
Name 3-Amino-4-(1-azepanyl)benzoic acid
Synonyms 3-amino-4-(1-azepanyl)benzoic acid; 3-amino-4-(azepan-1-yl)benzoic acid; 3-amino-4-azepan-1-ylbenzoic acid
Molecular Structure CAS#: 693805-72-0, 3-Amino-4-(1-azepanyl)benzoic acid
Molecular Formula C13H18N2O2
Molecular Weight 234.29
CAS Registry Number 693805-72-0
SMILES C1CCCN(CC1)C2=C(C=C(C=C2)C(=O)O)N
InChI 1S/C13H18N2O2/c14-11-9-10(13(16)17)5-6-12(11)15-7-3-1-2-4-8-15/h5-6,9H,1-4,7-8,14H2,(H,16,17)
InChIKey PNAOMCRVWSJFAJ-UHFFFAOYSA-N
Properties
Density 1.2±0.1g/cm3 (Cal.)
Boiling point 453.7±40.0°C at 760 mmHg (Cal.)
Flash point 228.2±27.3°C (Cal.)
Refractive index 1.604 (Cal.)
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