Urea,N-methyl-N-nitroso-N'-phenyl-

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Names

[ CAS No. ]:
21561-99-9

[ Name ]:
Urea,N-methyl-N-nitroso-N'-phenyl-

[Synonym ]:
Methylphenylnitrosourea
3-Phenyl-1-methyl-1-nitrosoharnstoff
Nitrosomethylphenylurea
N-Methyl-N-nitroso-N'-phenylurea
N-Methyl-N-nitroso-N'-phenyl-harnstoff
MPNU
N-Nitroso-N-methyl-N'-phenylharnstoff
Urea,1-methyl-1-nitroso-3-phenyl
1-Methyl-1-nitro-3-phenyl-harnstoff
N-methyl-N'-phenyl-N-nitrosourea

Chemical & Physical Properties

[ Density]:
1.22g/cm3

[ Molecular Formula ]:
C8H9N3O2

[ Molecular Weight ]:
179.17600

[ Exact Mass ]:
179.06900

[ PSA ]:
61.77000

[ LogP ]:
1.90470

[ Index of Refraction ]:
1.574

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
YT8100000
CHEMICAL NAME :
Urea, 1-methyl-1-nitroso-3-phenyl-
CAS REGISTRY NUMBER :
21561-99-9
LAST UPDATED :
199612
DATA ITEMS CITED :
10
MOLECULAR FORMULA :
C8-H9-N3-O2
MOLECULAR WEIGHT :
179.20
WISWESSER LINE NOTATION :
ONN1&VMR

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
750 mg/kg/32W-I
TOXIC EFFECTS :
Tumorigenic - Carcinogenic by RTECS criteria Gastrointestinal - tumors
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
250 mg/kg
TOXIC EFFECTS :
Tumorigenic - equivocal tumorigenic agent by RTECS criteria Tumorigenic - tumors at site of application
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
532 mg/kg/7W-I
TOXIC EFFECTS :
Tumorigenic - Carcinogenic by RTECS criteria Gastrointestinal - tumors Skin and Appendages - tumors
TYPE OF TEST :
TD - Toxic dose (other than lowest)
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
450 mg/kg/20W-I
TOXIC EFFECTS :
Tumorigenic - equivocal tumorigenic agent by RTECS criteria Gastrointestinal - tumors
TYPE OF TEST :
TD - Toxic dose (other than lowest)
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
650 mg/kg/W-I
TOXIC EFFECTS :
Tumorigenic - equivocal tumorigenic agent by RTECS criteria Gastrointestinal - tumors Liver - tumors
TYPE OF TEST :
TD - Toxic dose (other than lowest)
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
650 mg/kg/26W-I
TOXIC EFFECTS :
Tumorigenic - equivocal tumorigenic agent by RTECS criteria Gastrointestinal - tumors Liver - tumors
TYPE OF TEST :
TD - Toxic dose (other than lowest)
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
650 mg/kg/26W-I
TOXIC EFFECTS :
Tumorigenic - equivocal tumorigenic agent by RTECS criteria Kidney, Ureter, Bladder - Kidney tumors

MUTATION DATA

TYPE OF TEST :
Sister chromatid exchange
TEST SYSTEM :
Rodent - hamster Lung
DOSE/DURATION :
10 umol/L
REFERENCE :
IAPUDO IARC Publications. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) No.27- 1979- Volume(issue)/page/year: 31,797,1980

Safety Information

[ HS Code ]:
2924299090

Synthetic Route

Precursor & DownStream

Precursor

  • 1-METHYL-3-PHENYLUREA
  • Methylisocyanate 1 x 500mg neat
  • (Methylcarbamoyl)azid

DownStream

  • Carbamothioic acid,N-phenyl-, S-butyl ester
  • S-(4-methylphenyl) N-phenylcarbamothioate
  • N-phenyl-1-phenylsulfanyl-formamide
  • S-(2-methylpropyl) N-phenylcarbamothioate
  • S-tert-butyl N-phenylcarbamothioate
  • Phenylthiocarbamic acid S-(2-hydroxyethyl) ester
  • 1,3-Diphenylurea

Customs

[ HS Code ]: 2924299090

[ Summary ]:
2924299090. other cyclic amides (including cyclic carbamates) and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%


Related Compounds

  • Urea,N-methyl-N-nitroso-N'-(2,2,2-trifluoroethyl)-
  • 1-methyl-1-nitroso-3-(oxan-4-yl)urea
  • 3-benzyl-1-methyl-1-nitrosourea
  • 1-methyl-1-nitroso-3-(pyridin-3-ylmethyl)urea
  • Urea, N-methyl-N-nitroso-N-[2-(1H-purin-6-ylthio)ethyl]-
  • Urea, N-methyl-N-nitroso-N-(1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl)- (9CI)