1-(4-Chlorophenyl)-1,3-dimethylurea
Basic information
- CAS
13578-25-1- Standard SMILES
CNC(=O)N(C)c1ccc(Cl)cc1- InChIKey
XZTUYISAOWDOSC-UHFFFAOYSA-N- Molecular formula
- C9H11ClN2O
- Average molar mass
- 198.65 g/mol
- Monoisotopic mass
- 198.0559907
Names & identifiers
- Preferred name
- 1-(4-Chlorophenyl)-1,3-dimethylurea
- IUPAC
- 1-(4-chlorophenyl)-1,3-dimethylurea
- English name
- 1-(4-chlorophenyl)-1,3-dimethylurea
- Molecular formula
- C9H11ClN2O
- Molecular weight
- 198.65
Names & synonyms
1-(4-Chlorophenyl)-1,3-dimethylurea13578-25-1TTJ4GD2P3WN-(4-CHLOROPHENYL)-N,N'-DIMETHYLUREAEINECS 237-011-7UNII-TTJ4GD2P3Wp-chlorophenyl dimethyl ureaSCHEMBL5049977DTXSID90159516XZTUYISAOWDOSC-UHFFFAOYSA-NNS00024401
Database identifiers
- CAS
13578-25-1- PubChem CID
- 83593
- DTXSID
DTXSID90159516- UNII
- TTJ4GD2P3W
- EC Number
- 237-011-7
- Nikkaji
- J241.198I
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 178
Physicochemical properties
- FDA UNII
- 4 GD2P3W · TTJ4GD2P3W
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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