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Urea, 3-(4-acetoxycyclohexyl)-1-(2-fluoroethyl)-1-nitroso-

HCID 97403
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
33024-40-7
Standard SMILES
CC(=O)OC1CCC(NC(=O)N(CCF)N=O)CC1
InChIKey
FWQRRJUOMMCBNX-UHFFFAOYSA-N
Molecular formula
C11H18FN3O4
Average molar mass
275.28 g/mol
Monoisotopic mass
275.12813428

Names & identifiers

Preferred name
Urea, 3-(4-acetoxycyclohexyl)-1-(2-fluoroethyl)-1-nitroso-
IUPAC
4-{[(2-Fluoroethyl)(nitroso)carbamoyl]amino}cyclohexyl acetate
English name
N'-[4-(Acetyloxy)cyclohexyl]-N-(2-fluoroethyl)-N-nitrosourea
Molecular formula
C11H18FN3O4
Molecular weight
275.28

Names & synonyms

N'-[4-(Acetyloxy)cyclohexyl]-N-(2-fluoroethyl)-N-nitrosoureaUrea, N'-[4-(acetyloxy)cyclohexyl]-N-(2-fluoroethyl)-N-nitroso-

Database identifiers

CAS
33024-40-7
PubChem CID
97403
DTXSID
DTXSID50186686
ChEMBL
CHEMBL3250435、CHEMBL418159
Nikkaji
J54.233D

Properties

Physicochemical properties

Density
1.36 · 1.36±0.1 g/cm3(Predicted)
pka
10.45 · 10.45±0.40(Predicted)

Related reactions

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Compound notes

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