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55102-44-8

55102-44-8 structure
55102-44-8 structure
  • Name: Bofumustine
  • Chemical Name: Urea, N-(2-chloroethyl)-N'-[2,3-O-(1-methylethylidene)-5-O-(4-nitrobenzoyl)-D-ribofuranosyl]-N-nitroso
  • CAS Number: 55102-44-8
  • Molecular Formula: C18H21ClN4O9
  • Molecular Weight: 472.83400
  • Catalog: API Antineoplastic agents Alkylating agent
  • Create Date: 2018-02-16 08:00:00
  • Modify Date: 2024-04-03 10:21:42

Name Urea, N-(2-chloroethyl)-N'-[2,3-O-(1-methylethylidene)-5-O-(4-nitrobenzoyl)-D-ribofuranosyl]-N-nitroso
Synonyms ICIG-1105
Bofumustine
Density 1.61g/cm3
Boiling Point 124.5°C (rough estimate)
Melting Point 101.5°C
Molecular Formula C18H21ClN4O9
Molecular Weight 472.83400
Exact Mass 472.10000
PSA 161.58000
LogP 2.84250
Index of Refraction 1.647

CHEMICAL IDENTIFICATION

RTECS NUMBER :
YS5079000
CHEMICAL NAME :
Urea, 1-(2-chloroethyl)-1-nitroso-3-ribofuranosyl-, 5'-(p-nitrobenzoate), 2',3'-cyclic acetal with acetone
CAS REGISTRY NUMBER :
55102-44-8
LAST UPDATED :
199410
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C18-H21-Cl-N4-O9
MOLECULAR WEIGHT :
472.88
WISWESSER LINE NOTATION :
T55 BO DO GOTJ C1 C1 FMVNNO&2G H1OVR DNW

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
90 mg/kg
TOXIC EFFECTS :
Tumorigenic - active as anti-cancer agent

MUTATION DATA

TYPE OF TEST :
Mutation test systems - not otherwise specified
TEST SYSTEM :
Rodent - mouse Cells - not otherwise specified
DOSE/DURATION :
2 mg/L
REFERENCE :
INSSDM INSERM Symposium. (Elsevier Science Pub. Co., Inc., 52 Vanderbilt Ave., New York, NY 10017) No.1- 1975- Volume(issue)/page/year: 19,229,1981

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55102-44-8 structure

55102-44-8

Literature: Montero; Leydet; Messiez-Munoz; et al. European Journal of Medicinal Chemistry, 1984 , vol. 19, # 6 p. 512 - 518
Precursor  2

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