Product Name

  • Name

    4-[[4-[Bis(2-chloroethyl)amino]phenoxy]carbonylamino]benzoic acid

  • EINECS
  • CAS No. 148-78-7
  • Density 1.415g/cm3
  • Solubility
  • Melting Point
  • Formula C18H18 Cl2 N2 O4
  • Boiling Point 565.9°C at 760 mmHg
  • Molecular Weight 397.258
  • Flash Point 296°C
  • Transport Information
  • Appearance
  • Safety Poison by intraperitoneal route. See also CARBAMATES. When heated to decomposition it emits very toxic fumes of Cl− and NOx.
  • Risk Codes
  • Molecular Structure Molecular Structure of 148-78-7 (4-[[4-[Bis(2-chloroethyl)amino]phenoxy]carbonylamino]benzoic acid)
  • Hazard Symbols
  • Synonyms Carbanilicacid, p-carboxy-, N-[p-[bis(2-chloroethyl)amino]phenyl] ester (6CI,7CI,8CI);Phenol, p-[bis(2-chloroethyl)amino]-, p-carboxycarbanilate (ester) (8CI);4-[N,N,-bis-(2-Chloroethyl)amino]phenyl-N-(p-carboxyphenyl)carbamate;4-[N,N-Bis(2-chloroethyl)amino]phenyl-N-(p-carboxyphenyl)carbamate; IC 140;N-[p-[Bis(2-chloroethyl)amino]phenyl] p-carboxycarbanilate; NSC 130998; Phenol,p-[bis(2-chloroethyl)amino]-, ester with p-(carboxyamino)benzoic acid
  • PSA 78.87000
  • LogP 4.35270

IC 140 Chemical Properties

IUPAC Name: 4-[[4-[Bis(2-chloroethyl)amino]phenoxy]carbonylamino]benzoic acid
Empirical Formula: C18H18Cl2N2O4
Molecular Weight: 397.2525 
Index of Refraction: 1.649 
Molar Refractivity: 102.34 cm3
Molar Volume: 280.7 cm3
Surface Tension: 60.7 dyne/cm
Density: 1.415 g/cm3
Flash Point: 296 °C
Enthalpy of Vaporization: 89.41 kJ/mol
Boiling Point: 565.9 °C at 760 mmHg
Vapour Pressure: 1.21E-13 mmHg at 25 °C
Structure of IC 140 (CAS NO.148-78-7):
                           
Canonical SMILES: C1=CC(=CC=C1C(=O)O)NC(=O)OC2=CC=C(C=C2)N(CCCl)CCCl
InChI: InChI=1S/C18H18Cl2N2O4/c19-9-11-22(12-10-20)15-5-7-16(8-6-15)26-18(25)21-14-3-1-13(2-4-14)17(23)24/h1-8H,9-12H2,(H,21,25)(H,23,24)
InChIKey: CNLVZUPSGAAHAO-UHFFFAOYSA-N

IC 140 Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 290mg/kg (290mg/kg)   Journal of Medicinal Chemistry. Vol. 8, Pg. 167, 1965.
rat LD50 intraperitoneal 56mg/kg (56mg/kg)   Journal of Medicinal Chemistry. Vol. 8, Pg. 167, 1965.

IC 140 Safety Profile

Poison by intraperitoneal route. When heated to decomposition IC 140 (CAS NO.148-78-7) emits very toxic fumes of Cl− and NOx.

IC 140 Specification

 IC 140 , its cas register number is 148-78-7. It also can be called Carbanilic acid, p-carboxy-, (4-(bis(2-chloroethyl)amino)phenyl) ; N-(p-(Bis(2-chloroethyl)amino)phenyl) p-carboxycarbanilate ; p-(N,N-Di-2-chloroethylamino)phenyl N-(p-carboxyphenyl)carbamate ; and Carbanilic acid, p-carboxy-, N-(p-(bis(2-chloroethyl)amino)phenyl) ester (8CI) .

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