Basic information
- CAS
91621-12-4- Standard SMILES
O=C(NCCCl)NCc1ccco1- InChIKey
VVYXILGQLAJZQA-UHFFFAOYSA-N- Molecular formula
- C8H11ClN2O2
- Average molar mass
- 202.64 g/mol
- Monoisotopic mass
- 202.0509053
Overview
structure given in first source
Names & identifiers
- Preferred name
- 1-(2-Chloroethyl)-3-(2-furylmethyl)urea
- IUPAC
- 1-(2-chloroethyl)-3-(furan-2-ylmethyl)urea
- English name
- 1-(2-chloroethyl)-3-(2-furylmethyl)urea
- Molecular weight
- 0
Names & synonyms
1-(2-Chloroethyl)-3-(2-furylmethyl)ureaCEFMU91621-12-4NSC-162281GKB8G7434HDTXSID00238649Urea, N-(2-chloroethyl)-N'-(2-furanylmethyl)-, (S)-RefChem:74110DTXCID00161140NSC 162281NSC162281N-(2-Chloroethyl)-N'-(2-furanylmethyl)urea
Show more names
N-(2-Chloroethyl)-N'-[(furan-2-yl)methyl]ureaUrea, N-(2-chloroethyl)-N'-(2-furanylmethyl)-
Database identifiers
- CAS
91621-12-4- PubChem CID
- 98727
- DTXSID
DTXSID00238649- UNII
- GKB8G7434H
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 54.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 166
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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