Basic information
- CAS
33024-39-4- Standard SMILES
CC1(C)CCC(NC(=O)N(CCF)N=O)CC1- InChIKey
YKKMKHXIPGWYEP-UHFFFAOYSA-N- Molecular formula
- C11H20FN3O2
- Average molar mass
- 245.29 g/mol
- Monoisotopic mass
- 245.15395505
Names & identifiers
- Preferred name
- Urea, N'-(4,4-dimethylcyclohexyl)-N-(2-fluoroethyl)-N-nitroso-
- IUPAC
- 3-(4,4-dimethylcyclohexyl)-1-(2-fluoroethyl)-1-nitrosourea
- English name
- N'-(4,4-Dimethylcyclohexyl)-N-(2-fluoroethyl)-N-nitrosourea
- Molecular weight
- 0
Names & synonyms
33024-39-43-(4,4-Dimethylcyclohexyl)-1-(2-fluoroethyl)-1-nitrosoureaBRN 2132576NSC 132,920Urea, N'-(4,4-dimethylcyclohexyl)-N-(2-fluoroethyl)-N-nitroso-DTXSID90186685Urea, 3-(4,4-dimethylcyclohexyl)-1-(2-fluoroethyl)-1-nitroso-RefChem:387693DTXCID30109176Urea, N'-(4,4-dimethylcyclohexyl)-N-(2-fluoroethyl)-N-nitroso-(9CI)N'-(4,4-dimethylcyclohexyl)-N-(2-fluoroethyl)-N-nitrosoureaNSC132920
Show more names
NSC-132920ZRU7N65ABACHEMBL13016Urea, N'-(4,4-dimethylcyclohexyl)-N-(2-fluoroethyl)-N-nitroso- (9CI)NSC-132,920DB-265758Urea,4-dimethylcyclohexyl)-N-(2-fluoroethyl)-N-nitroso-Urea,4-dimethylcyclohexyl)-1-(2-fluoroethyl)-1-nitroso-
Database identifiers
- CAS
33024-39-4- PubChem CID
- 97564
- DTXSID
DTXSID90186685- ChEMBL
CHEMBL13016- UNII
- ZRU7N65ABA
- Nikkaji
- J54.435C
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 274
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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