Basic information
- CAS
73953-69-2- Standard SMILES
O=C(NCCCl)Nc1cccc2ccccc12- InChIKey
QXVKGKHOEIZXQW-UHFFFAOYSA-N- Molecular formula
- C13H13ClN2O
- Average molar mass
- 248.71 g/mol
- Monoisotopic mass
- 248.0716407
Names & identifiers
- Preferred name
- Urea, 1-(2-chloroethyl)-3-(1-naphthyl)-
- IUPAC
- 1-(2-chloroethyl)-3-naphthalen-1-ylurea
- English name
- 1-(1-Naphtyl)-3-(2-chloroethyl)urea
- Molecular formula
- C13H13ClN2O
- Molecular weight
- 248.71
Names & synonyms
73953-69-2Urea, 1-(2-chloroethyl)-3-(1-naphthyl)-DTXSID30224671RefChem:1100719DTXCID60147162Urea, N-(2-chloroethyl)-N'-1-naphthalenyl-1-(2-Chloroethyl)-3-(1-naphthyl)ureaNSC 79652BRN 2377274NSC79652WLN: L66J BMVM2G4-12-00-03076 (Beilstein Handbook Reference)
Show more names
1-(2-Chloroethyl)-3-(1-naphtyl)urea1-(1-Naphtyl)-3-(2-chloroethyl)urea
CHEMBL348908NSC-79652AKOS008937168N-(2-Chloroethyl)-N'-(naphthalen-1-yl)urea
Database identifiers
- CAS
73953-69-2- PubChem CID
- 96557
- DTXSID
DTXSID30224671- ChEMBL
CHEMBL348908- Nikkaji
- J83.902G
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 260
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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