Basic information
- CAS
13558-77-5- Standard SMILES
Cc1ccc(NC(=O)NC(=O)CCl)cc1- InChIKey
FLTLDRPQJUQSPI-UHFFFAOYSA-N- Molecular formula
- C10H11ClN2O2
- Average molar mass
- 226.66 g/mol
- Monoisotopic mass
- 226.0509053
Names & identifiers
- Preferred name
- N-(Chloroacetyl)-N'-(4-methylphenyl)urea
- IUPAC
- 2-chloro-N-[(4-methylphenyl)carbamoyl]acetamide
- English name
- 1-(2-chloroacetyl)-3-p-tolylurea
- Molecular formula
- C10H11ClN2O2
- Molecular weight
- 226.66
Names & synonyms
13558-77-53-(2-chloroacetyl)-1-(4-methylphenyl)urea1-(2-chloroacetyl)-3-p-tolylureaN-(Chloroacetyl)-N'-(4-methylphenyl)urea2-chloro-N-[(4-methylphenyl)carbamoyl]acetamideNSC287320A8TU9M7GRENSC-2873202-chloro-N-(p-tolylcarbamoyl)acetamideAcetamide, 2-chloro-N-[[(4-methylphenyl)amino]carbonyl]-NSC 287320UNII-A8TU9M7GRE
Show more names
CHEMBL227681DTXSID10159472NAA55877Urea, 1-(chloroacetyl)-3-p-tolyl-AKOS009147318NCGC00661105-01CS-0244770EN300-29260
Database identifiers
- CAS
13558-77-5- PubChem CID
- 323922
- DTXSID
DTXSID10159472- ChEMBL
CHEMBL227681- UNII
- A8TU9M7GRE
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 238
Physicochemical properties
- FDA UNII
- 8 TU9M7GRE · A8TU9M7GRE
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers1 total
宝欧信特生物科技（苏州）有限公司51288865780 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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