Products 55102-44-8

CAS 55102-44-8 is the registry number for Bofumustine. Offered by: TRC, MedChemExpress. Available pack sizes: 100mg, Get quote.

Bofumustine
TRC, MedChemExpress
  • size: 100mg, Get quote
  • Variants: 2
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Structural formula: {0} (CAS {1})

[(3aR,6R,6aR)-4-[[2-chloroethyl(nitroso)carbamoyl]amino]-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl 4-nitrobenzoate (CAS 55102-44-8) is a chemical compound with the molecular formula C18H21ClN4O9 and a molecular weight of 472.8 g/mol. IUPAC name: [(3aR,6R,6aR)-4-[[2-chloroethyl(nitroso)carbamoyl]amino]-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl 4-nitrobenzoate. InChIKey: YASNUXZKZNVXIS-CBNXCZCTSA-N.

Identity
Molecular formulaC18H21ClN4O9
Molecular weight472.8 g/mol
IUPAC name[(3aR,6R,6aR)-4-[[2-chloroethyl(nitroso)carbamoyl]amino]-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl 4-nitrobenzoate
InChIKeyYASNUXZKZNVXIS-CBNXCZCTSA-N
SMILESCC1(O[C@@H]2[C@H](OC([C@@H]2O1)NC(=O)N(CCCl)N=O)COC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C

Computed by PubChem (NCBI)

Synonyms: Bofumustine, Bofumustina, Bofumustinum, Rfcnu, Bofumustine [INN], Bofumustina [Spanish], Bofumustinum [INN-Latin], Bofumustina [INN-Spanish], Furo(3,4-d)-1,3-dioxole, urea deriv., orb1700973