Molecular Structure of 2-Chloro-N-[4-(trifluoromethyl)phenyl]acetamide (CAS No.2707-23-5):
Molecular Formula: C9H7ClF3NO
Molecular Weight: 237.6062
CAS No: 2707-23-5
H bond acceptors: 2
H bond donors: 1
Freely Rotating Bonds: 2
Polar Surface Area: 20.31 Å2
Index of Refraction: 1.513
Molar Refractivity: 50.35 cm3
Molar Volume: 167.4 cm3
Surface Tension: 34.8 dyne/cm
Density: 1.419 g/cm3
Flash Point: 155.5 °C
Enthalpy of Vaporization: 57.64 kJ/mol
Boiling Point: 333.5 °C at 760 mmHg
Vapour Pressure: 0.000136 mmHg at 25°C
IUPAC Name: 2-Chloro-N-[4-(trifluoromethyl)phenyl]acetamide
InChI: InChI=1/C9H7ClF3NO/c10-5-8(15)14-7-3-1-6(2-4-7)9(11,12)13/h1-4H,5H2,(H,14,15)
InChIKey: BHXKHTOSJBCCMU-UHFFFAOYAS
Std. InChI: InChI=1S/C9H7ClF3NO/c10-5-8(15)14-7-3-1-6(2-4-7)9(11,12)13/h1-4H,5H2,(H,14,15)
Std. InChIKey: BHXKHTOSJBCCMU-UHFFFAOYSA-N
Hazard Codes: Xi
Risk Statements: 20/21/22-36/37/38
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed.
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36/37/39
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection.
Hazard Note: Irritant
HazardClass: IRRITANT
2-Chloro-N-[4-(trifluoromethyl)phenyl]acetamide (CAS No.2707-23-5), its synonyms are Acetamide, 2-chloro-N-[4-(trifluoromethyl)phenyl]- ; N-Chloroacetyl-4-(trifluoromethyl)aniline ; 2-Chloro-4'-(trifluoromethyl)acetanilide .
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