N1-(3-Chlorophenyl)-2-methylpropane-1,2-diamine dihydrochloride
Basic information
- CAS
1443278-75-8- Standard SMILES
CC(C)(N)CNc1cccc(Cl)c1.Cl.Cl- InChIKey
GGASPAZLWAGXHW-UHFFFAOYSA-N- Molecular formula
- C10H17Cl3N2
- Average molar mass
- 271.6 g/mol
- Monoisotopic mass
- 270.045732
Names & identifiers
- Preferred name
- N1-(3-Chlorophenyl)-2-methylpropane-1,2-diamine dihydrochloride
- IUPAC
- 1-N-(3-chlorophenyl)-2-methylpropane-1,2-diamine;dihydrochloride
Names & synonyms
1443278-75-8N1-(3-CHLOROPHENYL)-2-METHYLPROPANE-1,2-DIAMINE DIHYDROCHLORIDEDTXSID401375989AKOS0243976581-N-(3-chlorophenyl)-2-methylpropane-1,2-diamine;dihydrochloride1,2-Propanediamine, N1-(3-chlorophenyl)-2-methyl-, hydrochloride (1:2)
Database identifiers
- CAS
1443278-75-8- PubChem CID
- 53444580
- DTXSID
DTXSID401375989
Properties
Computed structural properties
- Topological polar surface area
- 38.1 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 159
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Compound notes
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