Urea, 1-(2-chloroethyl)-3-(alpha-methyl-3-thenyl)-
Basic information
- CAS
102433-60-3- Standard SMILES
CC(NC(=O)NCCCl)c1ccsc1- InChIKey
PJGQEELZELMSLG-UHFFFAOYSA-N- Molecular formula
- C9H13ClN2OS
- Average molar mass
- 232.73 g/mol
- Monoisotopic mass
- 232.0437119
Names & identifiers
- Preferred name
- Urea, 1-(2-chloroethyl)-3-(alpha-methyl-3-thenyl)-
- IUPAC
- 1-(2-chloroethyl)-3-(1-thiophen-3-ylethyl)urea
Names & synonyms
1-(2-Chloroethyl)-3-(alpha-methyl-3-thenyl)urea102433-60-3Urea, 1-(2-chloroethyl)-3-(alpha-methyl-3-thenyl)-Urea, N-(2-chloroethyl)-N'-(alpha-methyl-3-thenyl)-RefChem:387355NSC168410DTXSID90907554NSC-168410N'-(2-Chloroethyl)-N-[1-(thiophen-3-yl)ethyl]carbamimidic acid
Database identifiers
- CAS
102433-60-3- PubChem CID
- 297301
- DTXSID
DTXSID90907554- Nikkaji
- J83.899C
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 69.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 192
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Compound notes
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