Urea, 1-(2-chloroethyl)-3-(1,2,3,4-tetrahydro-1-naphthyl)-
Basic information
- CAS
58490-96-3- Standard SMILES
O=C(NCCCl)NC1CCCc2ccccc21- InChIKey
SZPPMYAHPUVTME-UHFFFAOYSA-N- Molecular formula
- C13H17ClN2O
- Average molar mass
- 252.74 g/mol
- Monoisotopic mass
- 252.1029409
Names & identifiers
- Preferred name
- Urea, 1-(2-chloroethyl)-3-(1,2,3,4-tetrahydro-1-naphthyl)-
- IUPAC
- 1-(2-chloroethyl)-3-(1,2,3,4-tetrahydronaphthalen-1-yl)urea
Names & synonyms
58490-96-3Urea, 1-(2-chloroethyl)-3-(1,2,3,4-tetrahydro-1-naphthyl)-RefChem:11007173-(2-Chloroethyl)-1-(1,2,3,4-tetrahydro-1-naphthyl)ureaNSC160088SCHEMBL3735037SZPPMYAHPUVTME-UHFFFAOYSA-NDTXSID001384980NSC 160088NSC-1600881-(2-chloroethyl)-3-(1,2,3,4-tetrahydro-1-naphthyl)urea
Database identifiers
- CAS
58490-96-3- PubChem CID
- 98980
- DTXSID
DTXSID001384980
Properties
Computed structural properties
- XLogP
- 2.2
- 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
3 records
Compound notes
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