1,4-Benzodioxan-2-methylamine, N-(2-chloroethyl)-N-ethyl-, hydrochloride
Basic information
- CAS
51775-17-8- Standard SMILES
CC[NH+](CCCl)CC1COc2ccccc2O1.[Cl-]- InChIKey
KPHVVQCKSWBALP-UHFFFAOYSA-N- Molecular formula
- C13H19Cl2NO2
- Average molar mass
- 292.2 g/mol
- Monoisotopic mass
- 291.0792842
Names & identifiers
- Preferred name
- 1,4-Benzodioxan-2-methylamine, N-(2-chloroethyl)-N-ethyl-, hydrochloride
- IUPAC
- 2-chloroethyl-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-ethylazanium chloride
Names & synonyms
1,4-BENZODIOXAN-2-METHYLAMINE, N-(2-CHLOROETHYL)-N-ETHYL-, HYDROCHLORIDE51775-17-8RefChem:1053171N-(2-Chloroethyl)-N-ethyl-1,4-benzodioxan-2-methylamine hydrochloride3718 RPNSC 268772-(N-(2-Chloroethyl)-N-ethylaminomethyl)-1,4-benzodioxan hydrochlorideChlorhydrate de (N-ethyl,N,beta-chlorethyl)amino-methylbenzodioxane [French]1,4-Benzodioxin-2-methanamine, N-(2-chloroethyl)-N-ethyl-2,3-dihydro-, hydrochlorideChlorhydrate de (N-ethyl,N,beta-chlorethyl)amino-methylbenzodioxane
Database identifiers
- CAS
51775-17-8- PubChem CID
- 40124
Properties
Computed structural properties
- Topological polar surface area
- 22.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 227
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Compound notes
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