Basic information
- CAS
62979-76-4- Standard SMILES
Cc1ccc(C(N)=[NH+]CC[NH+](C)C)cc1.[Cl-].[Cl-]- InChIKey
MSZZLRNJHXLIPH-UHFFFAOYSA-N- Molecular formula
- C12H21Cl2N3
- Average molar mass
- 278.22 g/mol
- Monoisotopic mass
- 277.1112531
Names & identifiers
- Preferred name
- Benzamidine, N-(2-dimethylaminoethyl)-4-methyl-, dihydrochloride
- IUPAC
- 2-[amino-(4-methylphenyl)methylidene]azaniumylethyl-dimethylazanium dichloride
Names & synonyms
N-(2-Dimethylaminoethyl)-4-methylbenzamidine dihydrochloride62979-76-4BENZAMIDINE, N-(2-DIMETHYLAMINOETHYL)-4-METHYL-, DIHYDROCHLORIDERefChem:322654
Database identifiers
- CAS
62979-76-4- PubChem CID
- 44235
Properties
Computed structural properties
- Topological polar surface area
- 44.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 203
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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