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

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Names

[ CAS No. ]:
106871-13-0

[ Name ]:
((3-(bis(2-chloroethyl)amino)-4-methylphenyl)hydroxymethane)bisphosphonic acid

Chemical & Physical Properties

[ 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

Toxicological Information

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

Related Compounds

1-(Benzo[d][1,3]dioxol-5-yl)-3-(5-benzyl-1,3,4-oxadiazol-2-yl)urea
1-Allyl-3-(5-benzyl-1,3,4-oxadiazol-2-yl)urea
[1-Methyl-3-(propan-2-YL)-1H-pyrazol-4-YL]methanol
1-(3,4-Dimethoxybenzyl)-3-(5-(4-fluorobenzyl)-1,3,4-oxadiazol-2-yl)urea
1-(5-(4-Fluorobenzyl)-1,3,4-oxadiazol-2-yl)-3-(2-(trifluoromethyl)phenyl)urea
1-(5-(4-Fluorobenzyl)-1,3,4-oxadiazol-2-yl)-3-(2-methoxyethyl)urea
1-Allyl-3-(5-(4-fluorobenzyl)-1,3,4-oxadiazol-2-yl)urea
5-bromo-3-methyl-N-(prop-2-yn-1-yl)furan-2-carboxamide
1-(2-Fluorophenyl)-3-(5-(4-methoxybenzyl)-1,3,4-oxadiazol-2-yl)urea
1-(5-(4-Methoxybenzyl)-1,3,4-oxadiazol-2-yl)-3-(3-(trifluoromethyl)phenyl)urea

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