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Name	Imidazole mustard	EINECS	N/A
CAS No.	5034-77-5	Density	1.59g/cm³
PSA	99.73000	LogP	1.98720
Solubility	N/A	Melting Point	N/A
Formula	C8H12 Cl2 N6 O	Boiling Point	415.2°Cat760mmHg
Molecular Weight	279.129	Flash Point	204.9°C
Transport Information	N/A	Appearance	N/A
Safety	Suspected carcinogen with experimental neoplastigenic and tumorigenic data. Poison by ingestion and intraperitoneal routes. Experimental teratogenic effects. Human systemic effects by intravenous route: nausea. When heated to decomposition it emits very toxic fumes of Cl⁻ and NO_x.	Risk Codes	N/A
Molecular Structure		Hazard Symbols	N/A
Synonyms	Imidazole-4(or5)-carboxamide, 5(or 4)-[3,3-bis(2-chloroethyl)-1-triazeno]- (7CI); Imidazole-4-carboxamide,5-[3,3-bis(2-chloroethyl)-1-triazeno]- (8CI); 5(or4)-[3,3-Bis(2-chloroethyl)-1-triazeno]imidazole-4(or 5)-carboxamide;5-[3,3-Bis(2-chlorethyl)-1-triazeno]imidazole-4-carboxamide;5-[3,3-Bis(2-chloroethyl)-1-triazeno]imidazole-4-carboxamide;5-[3,3-Bis(2-chloroethyl)-1-triazenyl]imidazole-4-carboxamide;5-[3,3-Bis(2-chloroethyl)triazeno]imidazole-4-carboxamide; BIC; Imidazolemustard; NSC 82196	Article Data	2

Imidazole mustard Chemical Properties

IUPAC Name: 4-[(E)-bis(2-chloroethyl)aminodiazenyl]-4H-imidazole-5-carboxamide
Synonyms of Imidazole mustard (CAS NO.5034-77-5) : 1H-Imidazole-4-carboxamide, 5-(3,3-bis(2-chloroethyl)-1-triazenyl)- (9CI) ; Imidazole-4-carboxamide, 5-(3,3-bis(2-chloroethyl)-1-triazeno)- ; 5-(3,3-Bis(2-Chlorethyl)-1-triazeno)-imidazole-4-carboxamide ; 5-(3,3-Bis(2-Chloroethyl)-1-triazeno)imidazole-4-carboxamide
InChI:InChI=1/C8H12Cl2N6O/c9-1-3-16(4-2-10)15-14-8-6(7(11)17)12-5-13-8/h5,8H,1-4H2,(H2,11,17)/b15-14+
CAS NO: 5034-77-5
Molecular Formula:C₈H₁₂Cl₂N₆O
Molecular Weight :279.1265
Molecular Structure :
Index of Refraction: 1.663
Surface Tension: 62.1 dyne/cm
Density: 1.59 g/cm³
Flash Point: 213 °C
Enthalpy of Vaporization: 68.38 kJ/mol
Boiling Point: 428.6 °C at 760 mmHg
Vapour Pressure: 1.49E-07 mmHg at 25°C

Imidazole mustard Uses

Imidazole mustard (CAS NO.5034-77-5) is used as intermediate in organic synthesis.

Imidazole mustard Toxicity Data With Reference

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
human	TDLo	intravenous	9gm/kg (9000mg/kg)	GASTROINTESTINAL: NAUSEA OR VOMITING	Cancer Chemotherapy Reports, Part 1. Vol. 56, Pg. 671, 1972.
mouse	LD50	intraperitoneal	60060ug/kg (60.06mg/kg)		National Cancer Institute Screening Program Data Summary, Developmental Therapeutics Program. Vol. JAN1986,
rat	LD50	intraperitoneal	210mg/kg (210mg/kg)		National Cancer Institute Screening Program Data Summary, Developmental Therapeutics Program. Vol. JAN1986,
rat	LD50	oral	267mg/kg (267mg/kg)		National Cancer Institute Screening Program Data Summary, Developmental Therapeutics Program. Vol. JAN1986,

Imidazole mustard Consensus Reports

NCI Carcinogenesis Studies (ipr); Clear Evidence: mouse, rat CANCAR Cancer. 40 (1977),1935. .

Imidazole mustard Safety Profile

Suspected carcinogen with experimental neoplastigenic and tumorigenic data. Poison by ingestion and intraperitoneal routes. Experimental teratogenic effects. Human systemic effects by intravenous route: nausea. When Imidazole mustard (CAS NO.5034-77-5) is heated to decomposition, it emits very toxic fumes of Cl⁻ and NO_x.

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