Basic information
- CAS
101651-65-4- Standard SMILES
C[NH+](C)CC[NH+](C)CC(=O)Nc1ccccc1Cl.[Cl-].[Cl-]- InChIKey
XELBOPHJKRXBEN-UHFFFAOYSA-N- Molecular formula
- C13H22Cl3N3O
- Average molar mass
- 342.7 g/mol
- Monoisotopic mass
- 341.082845
Names & identifiers
- Preferred name
- Acetanilide, o-chloro-2-(methyl(2-(dimethylamino)ethyl)amino)-, dihydrochloride
- IUPAC
- [2-(2-chloroanilino)-2-oxoethyl]-[2-(dimethylazaniumyl)ethyl]-methylazanium dichloride
Names & synonyms
101651-65-4ACETANILIDE, o-CHLORO-2-(METHYL(2-(DIMETHYLAMINO)ETHYL)AMINO)-, DIHYDROCHLORIDERefChem:1075486C 5415o-Chloro-2-(methyl(2-(dimethylamino)ethyl)amino)acetanilide dihydrochloride
Database identifiers
- CAS
101651-65-4- PubChem CID
- 58624
Properties
Computed structural properties
- Topological polar surface area
- 38 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 261
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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