Basic information
- CAS
50283-06-2- Standard SMILES
COCCN(CCCl)Cc1ccccc1- InChIKey
GVSPFGGUBVUVMN-UHFFFAOYSA-N- Molecular formula
- C12H18ClNO
- Average molar mass
- 227.73 g/mol
- Monoisotopic mass
- 227.1076919
Names & identifiers
- Preferred name
- Benzylamine, N-(2-chloroethyl)-N-(2-methoxyethyl)-
- IUPAC
- N-benzyl-N-(2-chloroethyl)-2-methoxyethanamine
Names & synonyms
N-(2-Methoxyethyl)-N-benzyl-2-chloroethylamineBENZYLAMINE, N-(2-CHLOROETHYL)-N-(2-METHOXYETHYL)-N-(2-Chloroethyl)-N-(2-methoxyethyl)benzylamine50283-06-2DTXSID30198287RefChem:328808DTXCID60120778SCHEMBL9504529AKOS012695989N-(2-chloroethyl)-N-(2-methoxyethyl)-ben-zylamineN-Benzyl-2-chloro-N-(2-methoxyethyl)ethan-1-amine
Database identifiers
- CAS
50283-06-2- PubChem CID
- 39586
- DTXSID
DTXSID30198287- Nikkaji
- J69.057K
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 12.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 149
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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