Urea, 1-(2-chloroethyl)-1-nitroso-3-p-tolyl-
Basic information
- CAS
14009-34-8- Standard SMILES
Cc1ccc(NC(=O)N(CCCl)N=O)cc1- InChIKey
ASFTZROWZQVWMX-UHFFFAOYSA-N- Molecular formula
- C10H12ClN3O2
- Average molar mass
- 241.67 g/mol
- Monoisotopic mass
- 241.0618043
Names & identifiers
- Preferred name
- Urea, 1-(2-chloroethyl)-1-nitroso-3-p-tolyl-
- IUPAC
- 1-(2-chloroethyl)-3-(4-methylphenyl)-1-nitrosourea
Names & synonyms
Urea, 1-(2-chloroethyl)-1-nitroso-3-p-tolyl-14009-34-8NSC102869NCIOpen2_007173DTXSID10930703NSC-102869DS-012521N-(2-Chloroethyl)-N'-(4-methylphenyl)-N-nitrosourea
Database identifiers
- CAS
14009-34-8- PubChem CID
- 265993
- DTXSID
DTXSID10930703
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 242
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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