Basic information
- CAS
30389-88-9- Standard SMILES
Cc1cc(C)c(CN(CCCl)CCCl)cc1C- InChIKey
HLRYARIRUPVGHR-UHFFFAOYSA-N- Molecular formula
- C14H21Cl2N
- Average molar mass
- 274.2 g/mol
- Monoisotopic mass
- 273.1051051
Names & identifiers
- Preferred name
- Benzylamine, N,N-bis(2-chloroethyl)-2,4,5-trimethyl-
- IUPAC
- 2-chloro-N-(2-chloroethyl)-N-[(2,4,5-trimethylphenyl)methyl]ethanamine
Names & synonyms
BRN 2647139BENZYLAMINE, N,N-BIS(2-CHLOROETHYL)-2,4,5-TRIMETHYL-N,N-Bis(2-chloroethyl)-2,4,5-trimethylbenzylamine30389-88-9Benzenemethanamine, N,N-bis(2-chloroethyl)-2,4,5-trimethyl-DTXSID001844754-12-00-02852 (Beilstein Handbook Reference)RefChem:328788DTXCID101069662-Chloro-N-(2-chloroethyl)-N-[(2,4,5-trimethylphenyl)methyl]ethan-1-amine
Database identifiers
- CAS
30389-88-9- PubChem CID
- 35328
- DTXSID
DTXSID00184475
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 204
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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