Basic information
- CAS
5767-43-1- Standard SMILES
Cl.O=c1[nH]cc(CN(CCF)CCCl)c(=O)[nH]1- InChIKey
XKWVPJJOBRKLLI-UHFFFAOYSA-N- Molecular formula
- C9H14Cl2FN3O2
- Average molar mass
- 286.13 g/mol
- Monoisotopic mass
- 285.0447102
Names & identifiers
- Preferred name
- Uracil, 5-(((2-chloroethyl)(2-fluoroethyl)amino)methyl)-, monohydrochloride
- IUPAC
- 5-[[2-chloroethyl(2-fluoroethyl)amino]methyl]-1H-pyrimidine-2,4-dione;hydrochloride
Names & synonyms
Uracil, 5-(((2-chloroethyl)(2-fluoroethyl)amino)methyl)-, monohydrochloride5767-43-15-(2-Chloroethyl)(2-fluoroethyl)aminomethyluracil hydrochlorideDTXSID50206373RefChem:387002DTXCID50128864FNY5-{[(2-Chloroethyl)(2-fluoroethyl)amino]methyl}pyrimidine-2,4(1H,3H)-dione--hydrogen chloride (1/1)
Database identifiers
- CAS
5767-43-1- PubChem CID
- 201279
- DTXSID
DTXSID50206373
Properties
Computed structural properties
- Topological polar surface area
- 61.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 309
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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