3-Chloro-4-(1-Pyrrolidinyl)Benzoic Acid
[CAS# 585517-09-5]

Identification

• Name: 3-Chloro-4-(1-Pyrrolidinyl)Benzoic Acid
• Synonyms: 3-chloro-4-pyrrolidin-1-ylbenzoic acid; 3-Chloro-4-pyrrolidinobenzoic Acid; MFCD02628415
• Molecular Formula: C₁₁H₁₂ClNO₂
• Molecular Weight: 225.67
• CAS Registry Number: 585517-09-5
• SMILES: O=C(O)c1cc(Cl)c(cc1)N2CCCC2
• InChI: 1S/C11H12ClNO2/c12-9-7-8(11(14)15)3-4-10(9)13-5-1-2-6-13/h3-4,7H,1-2,5-6H2,(H,14,15)
• InChIKey: ICTYJBKSXOEFEB-UHFFFAOYSA-N

Properties

• Density: 1.34g/cm³ (Cal.)
• Boiling point: 396.418°C at 760 mmHg (Cal.)
• Flash point: 193.547°C (Cal.)
• Refractive index: 1.608 (Cal.)