Basic information
- CAS
69796-25-4- Standard SMILES
Cc1cccc(NC(=O)NC(O)C(Cl)(Cl)Cl)c1- InChIKey
MZPAIJKEIYAOBM-UHFFFAOYSA-N- Molecular formula
- C10H11Cl3N2O2
- Average molar mass
- 297.6 g/mol
- Monoisotopic mass
- 295.988611
Names & identifiers
- Preferred name
- 1-(3-Methylphenyl)-3-(2,2,2-trichloro-1-hydroxyethyl)urea
- IUPAC
- 1-(3-methylphenyl)-3-(2,2,2-trichloro-1-hydroxyethyl)urea
Names & synonyms
69796-25-41-(3-methylphenyl)-3-(2,2,2-trichloro-1-hydroxyethyl)ureaNSC74643DTXSID20291276NSC-74643DS-012559Urea,2,2-trichloro-1-hydroxyethyl)-1-m-tolyl-1-(m-tolyl)-3-(2,2,2-trichloro-1-hydroxy-ethyl)ureaUrea, 1-m-tolyl-3-(2,2,2-trichloro-1-hydroxyethyl)-N-(3-Methylphenyl)-N'-(2,2,2-trichloro-1-hydroxyethyl)ureaUrea,n-(3-methylphenyl)-n-(2,2,2-trichloro-1-hydroxyethyl)-
Database identifiers
- CAS
69796-25-4- PubChem CID
- 252573
- DTXSID
DTXSID20291276
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 61.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 271
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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