Urea, 1-(2-chloroethyl)-3-(4-cyclohexylmethyl-1-cyclohexyl)-
Basic information
- CAS
37621-87-7- Standard SMILES
O=C(NCCCl)NC1CCC(CC2CCCCC2)CC1- InChIKey
YLNNHKVIBWWYBV-UHFFFAOYSA-N- Molecular formula
- C16H29ClN2O
- Average molar mass
- 300.9 g/mol
- Monoisotopic mass
- 300.1968412
Names & identifiers
- Preferred name
- Urea, 1-(2-chloroethyl)-3-(4-cyclohexylmethyl-1-cyclohexyl)-
- IUPAC
- 1-(2-chloroethyl)-3-[4-(cyclohexylmethyl)cyclohexyl]urea
Names & synonyms
BRN 2126708Urea, 1-(2-chloroethyl)-3-(4-cyclohexylmethyl-1-cyclohexyl)-37621-87-71-(2-Chloroethyl)-3-(4-cyclohexylmethylcyclohexyl)ureaDTXSID50191058RefChem:387343DTXCID60113549N-(2-Chloroethyl)-N'-[4-(cyclohexylmethyl)cyclohexyl]urea
Database identifiers
- CAS
37621-87-7- PubChem CID
- 216698
- DTXSID
DTXSID50191058- Nikkaji
- J83.846B
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 284
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Compound notes
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