Basic information
- CAS
31502-31-5- Standard SMILES
CN(C)c1cc2ccccc2c(N)n1.Cl- InChIKey
BDCUJCOYXRXLTE-UHFFFAOYSA-N- Molecular formula
- C11H14ClN3
- Average molar mass
- 223.7 g/mol
- Monoisotopic mass
- 223.0876252
Names & identifiers
- Preferred name
- 1-Imino-N,N-dimethyl-1,2-dihydroisoquinolin-3-amine--hydrogen chloride (1/1)
- IUPAC
- 3-N,3-N-dimethylisoquinoline-1,3-diamine;hydrochloride
Names & synonyms
DTXSID109534921-Imino-N,N-dimethyl-1,2-dihydroisoquinolin-3-amine--hydrogen chloride (1/1)RefChem:1055603DTXCID50138154337989-08-51-Amino-3-(dimethylamino)isoquinoline monohydrochloride1-amino-3-(dimethylamino)isoquinoline hydrochlorideIsoquinoline, 1-amino-3-(dimethylamino)-, monohydrochloride1,3-Isoquinolinediamine, N(sup 3),N(sup 3)-dimethyl-, monohydrochloride
Database identifiers
- CAS
31502-31-5、37989-08-5- PubChem CID
- 217005
- DTXSID
DTXSID10953492
Properties
Computed structural properties
- Topological polar surface area
- 42.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 193
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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