p-(bis(2-Chloroethyl)amino)phenyl-2,6-dimethylbenzoate supplier

Name
2,6-Dimethylbenzoic acid 4-[bis(2-chloroethyl)amino]phenyl ester
EINECS
CAS No. 21667-01-6
Article Data1
CAS DataBase
Density 1.224g/cm³
Solubility
Melting Point
Formula C₁₉H₂₁Cl₂NO₂
Boiling Point 517.4°Cat760mmHg
Molecular Weight 366.31
Flash Point 266.7°C
Transport Information
Appearance
Safety Poison by intraperitoneal route. When heated to decomposition it emits very toxic fumes of Cl⁻ and NO_x.
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms P-(BIS(2-CHLOROETHYL)AMINO)PHENYL-2,6-DIMETHYLBENZOATE;2,6-Dimethylbenzoesaeure-4-[N,N-bis-(2-chlorethyl)-amino]-phenylester;
PSA 29.54000
LogP 4.80660

p-(bis(2-Chloroethyl)amino)phenyl-2,6-dimethylbenzoate Chemical Properties

IUPAC Name: [4-[bis(2-Chloroethyl)amino]phenyl] 2,6-dimethylbenzoate
Synonyms of p-(bis(2-Chloroethyl)amino)phenyl-2,6-dimethylbenzoate (CAS NO.21667-01-6): Benzoic acid, 2,6-dimethyl-, p-(bis(2-chloroethyl)amino)phenyl ester ; p-(Bis(2-chloroethyl)amino)phenol 2,6-dimethylbenzoate ; Phenol, p-(bis(2-chloroethyl)amino)-,2,6-dimethylbenzoate
CAS NO: 21667-01-6
Molecular Formula: C₁₉H₂₁Cl₂NO₂
Molecular Weight : 366.2815
Molecular Structure:
H bond acceptors: 3
H bond donors: 0
Freely Rotating Bonds: 8
Polar Surface Area: 29.54 Å²
Index of Refraction: 1.589
Molar Refractivity: 100.82 cm³
Molar Volume: 299.1 cm³
Surface Tension: 45.8 dyne/cm
Density: 1.224 g/cm³
Flash Point: 266.7 °C
Enthalpy of Vaporization: 78.97 kJ/mol
Boiling Point: 517.4 °C at 760 mmHg
Vapour Pressure: 8.23E-11 mmHg at 25°C

p-(bis(2-Chloroethyl)amino)phenyl-2,6-dimethylbenzoate Toxicity Data With Reference

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mouse	LD50	intraperitoneal	500mg/kg (500mg/kg)		Journal of Medicinal Chemistry. Vol. 12, Pg. 491, 1969.
rat	LD50	intraperitoneal	290mg/kg (290mg/kg)		Journal of Medicinal Chemistry. Vol. 12, Pg. 491, 1969.

p-(bis(2-Chloroethyl)amino)phenyl-2,6-dimethylbenzoate Safety Profile

Poison by intraperitoneal route. When p-(bis(2-Chloroethyl)amino)phenyl-2,6-dimethylbenzoate (CAS NO.21667-01-6): is heated to decomposition, it emits very toxic fumes of Cl⁻ and NO_x.

Product Name

2,6-Dimethylbenzoic acid 4-[bis(2-chloroethyl)amino]phenyl ester

p-(bis(2-Chloroethyl)amino)phenyl-2,6-dimethylbenzoate Chemical Properties

p-(bis(2-Chloroethyl)amino)phenyl-2,6-dimethylbenzoate Toxicity Data With Reference

p-(bis(2-Chloroethyl)amino)phenyl-2,6-dimethylbenzoate Safety Profile

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