((3-(bis(2-chloroethyl)amino)-4-methylphenyl)hydroxymethane)bisphosphonic acid

Modify Date: 2024-01-17 18:39:40

((3-(bis(2-chloroethyl)amino)-4-methylphenyl)hydroxymethane)bisphosphonic acid structure	Common Name	((3-(bis(2-chloroethyl)amino)-4-methylphenyl)hydroxymethane)bisphosphonic acid
	CAS Number	106871-13-0	Molecular Weight	422.13500
	Density	1.672g/cm3	Boiling Point	720.3ºC at 760mmHg
	Molecular Formula	C₁₂H₁₉Cl₂NO₇P₂	Melting Point	N/A
	MSDS	N/A	Flash Point	389.4ºC

Name	[[3-[bis(2-chloroethyl)amino]-4-methylphenyl]-hydroxy-phosphonomethyl]phosphonic acid

Density	1.672g/cm3
Boiling Point	720.3ºC at 760mmHg
Molecular Formula	C₁₂H₁₉Cl₂NO₇P₂
Molecular Weight	422.13500
Flash Point	389.4ºC
Exact Mass	421.00100
PSA	158.15000
LogP	1.73700
Vapour Pressure	8.98E-22mmHg at 25°C
Index of Refraction	1.633

CHEMICAL IDENTIFICATION

RTECS NUMBER :: SZ6790000

CHEMICAL NAME :: Phosphonic acid, ((3-(bis(2-chloroethyl)amino)-4-methylphenyl)hydroxym ethylene)bis-

CAS REGISTRY NUMBER :: 106871-13-0

LAST UPDATED :: 199410

DATA ITEMS CITED :: 4

MOLECULAR FORMULA :: C12-H19-Cl2-N-O7-P2

MOLECULAR WEIGHT :: 422.16

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 88 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

MUTATION DATA

TYPE OF TEST :: DNA damage

TEST SYSTEM :: Rodent - hamster Embryo

DOSE/DURATION :: 1250 ug/plate

REFERENCE :: INNDDK Investigational New Drugs. The Journal of New Anticancer Agents. Kluwer Academic Pub., POB 358, Accord Stn., Hingham, MA 02018) V.1- 1983- Volume(issue)/page/year: 6,67,1988