Basic information
- CAS
23173-38-8- Standard SMILES
CC(C(Cl)c1ccccc1)N(C)CCCl.Cl- InChIKey
UYACBHZUKIRBMI-UHFFFAOYSA-N- Molecular formula
- C12H18Cl3N
- Average molar mass
- 282.6 g/mol
- Monoisotopic mass
- 281.050483
Names & identifiers
- Preferred name
- 1-Chloro-N-(2-chloroethyl)-N-methyl-1-phenylpropan-2-amine--hydrogen chloride (1/1)
- IUPAC
- 1-chloro-N-(2-chloroethyl)-N-methyl-1-phenylpropan-2-amine;hydrochloride
Names & synonyms
DTXSID0094584623173-38-81-Chloro-N-(2-chloroethyl)-N-methyl-1-phenylpropan-2-amine--hydrogen chloride (1/1)RefChem:1055269DTXCID201374147Propane, 1-phenyl-1-chloro-(2-methyl-2-chloroethyl)amine hydrochloridePhenethylamine, beta-chloro-N-(2-chloroethyl)-alpha,N-dimethyl-, hydrochloride
Database identifiers
- CAS
23173-38-8- PubChem CID
- 211461
- DTXSID
DTXSID00945846
Properties
Computed structural properties
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 169
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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