3-(Phenylamino)cyclohex-2-enone , 95+% , 24706-50-1

CAS NO.：24706-50-1

Empirical Formula: C12H13NO

Molecular Weight: 187.24

MDL number: MFCD00082654

PRODUCT Properties

• Melting point: 178-182 °C
• Boiling point: 324.9±42.0 °C(Predicted)
• Density: 1.176±0.06 g/cm3(Predicted)
• pka: 0.38±0.20(Predicted)
• form: solid
• BRN: 2103381
• InChI: 1S/C12H13NO/c14-12-8-4-7-11(9-12)13-10-5-2-1-3-6-10/h1-3,5-6,9,13H,4,7-8H2
• InChIKey: IVONJXTZXFTWNA-UHFFFAOYSA-N
• SMILES: O=C1C=C(CCC1)NC2=CC=CC=C2
• CAS DataBase Reference: 24706-50-1(CAS DataBase Reference)

Safety

• Hazard Codes: Xi
• Risk Statements: 36/37/38
• Safety Statements: 24/25
• WGK Germany: WGK 3
• RTECS: GW7600000
• Hazard Note: Irritant
• HS Code: 29214200
• Storage Class: 11 - Combustible Solids
• Toxicity: mouse,LDLo,intraperitoneal,600mg/kg (600mg/kg),Japanese Kokai Tokyo Koho Patents. Vol. #92-282314,