N(sup 4),N(sup 4)-Bis(2-chloroethyl)sulfanilamide supplier

Name
4-[Bis(2-chloroethyl)amino]benzenesulfonamide
EINECS
CAS No. 2045-41-2
Density 1.4g/cm³
Solubility
Melting Point
Formula C₁₀H₁₄Cl₂N₂O₂S
Boiling Point 474.5°Cat760mmHg
Molecular Weight 297.22
Flash Point 240.8°C
Transport Information
Appearance
Safety Poison by intraperitoneal route. When heated to decomposition it emits very toxic fumes of Cl⁻, NO_x, and SO_x.
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Sulfanilamide,N(sup 4),N(sup 4)-bis(2-chloroethyl);I.C. 20;Benzenesulfonamide,4-(bis(2-chloroethyl)amino);4--benzol-sulfonamid-(1);n(sup4),n(sup4)-Bis(2-chloroethyl)sulfanilamide;N4,N4-Bis-(2-chlor-ethyl)-sulfanilamid;
PSA 71.78000
LogP 3.39910

N(sup 4),N(sup 4)-Bis(2-chloroethyl)sulfanilamide Chemical Properties

Molecule structure of N(sup 4),N(sup 4)-Bis(2-chloroethyl)sulfanilamide (CAS NO.2045-41-2):

IUPAC Name: 4-[Bis(2-chloroethyl)amino]benzenesulfonamide
Molecular Weight: 297.20136 g/mol
Molecular Formula: C₁₀H₁₄Cl₂N₂O₂S
Density: 1.4 g/cm³
Boiling Point: 474.5 °C at 760 mmHg
Flash Point: 240.8 °C
Index of Refraction: 1.586
Molar Refractivity: 71.25 cm³
Molar Volume: 212.1 cm³
Polarizability: 28.24×10^-24 cm³
Surface Tension: 54.2 dyne/cm
Enthalpy of Vaporization: 73.79 kJ/mol
Vapour Pressure: 3.59E-09 mmHg at 25 °C
XLogP3: 1.9
H-Bond Donor: 1
H-Bond Acceptor: 4
Rotatable Bond Count: 6
Exact Mass: 296.015304
MonoIsotopic Mass: 296.015304
Topological Polar Surface Area: 63.4
Heavy Atom Count: 17
Complexity: 305
Canonical SMILES: C1=CC(=CC=C1N(CCCl)CCCl)S(=O)(=O)N
InChI: InChI=1S/C10H14Cl2N2O2S/c11-5-7-14(8-6-12)9-1-3-10(4-2-9)17(13,15)16/h1-4H,5-8H2,(H2,13,15,16)
InChIKey of N(sup 4),N(sup 4)-Bis(2-chloroethyl)sulfanilamide (CAS NO.2045-41-2): PRZVDHWOIZGGKL-UHFFFAOYSA-N

N(sup 4),N(sup 4)-Bis(2-chloroethyl)sulfanilamide Toxicity Data With Reference

1.		ipr-rat LD50:336 mg/kg		JMCMAR Journal of Medicinal Chemistry. 8 (1965),167.
2.		ipr-mus LD50:410 mg/kg		JMCMAR Journal of Medicinal Chemistry. 8 (1965),167.

N(sup 4),N(sup 4)-Bis(2-chloroethyl)sulfanilamide Safety Profile

Poison by intraperitoneal route. When heated to decomposition it emits very toxic fumes of Cl⁻, NO_x, and SO_x.

N(sup 4),N(sup 4)-Bis(2-chloroethyl)sulfanilamide Specification

N(sup 4),N(sup 4)-Bis(2-chloroethyl)sulfanilamide (CAS NO.2045-41-2) is also named as BRN 2698013 ; I.C. 20 ; NSC 294899 ; Sulfanilamide, n(sup4),n(sup4)-bis(2-chloroethyl)- ; n(sup4),n(sup4)-Bis(2-chloroethyl)sulfanilamide ; Benzenesulfonamide, 4-(bis(2-chloroethyl)amino)- (9CI) ; Sulfanilamide, N4,N4-bis(2-chloroethyl)- (8CI) .

Product Name

4-[Bis(2-chloroethyl)amino]benzenesulfonamide

N(sup 4),N(sup 4)-Bis(2-chloroethyl)sulfanilamide Chemical Properties

N(sup 4),N(sup 4)-Bis(2-chloroethyl)sulfanilamide Toxicity Data With Reference

N(sup 4),N(sup 4)-Bis(2-chloroethyl)sulfanilamide Safety Profile

N(sup 4),N(sup 4)-Bis(2-chloroethyl)sulfanilamide Specification

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