2,6-Dimethylbenzene-1,3,5-triamine hydrochloride
Basic information
- CAS
94135-20-3- Standard SMILES
Cc1c(N)cc(N)c(C)c1N.Cl- InChIKey
HUPRNZLUDKGPHB-UHFFFAOYSA-N- Molecular formula
- C8H14ClN3
- Average molar mass
- 187.67 g/mol
- Monoisotopic mass
- 187.0876252
Names & identifiers
- Preferred name
- 2,6-Dimethylbenzene-1,3,5-triamine hydrochloride
- IUPAC
- 2,4-dimethylbenzene-1,3,5-triamine;hydrochloride
- English name
- 2,6-dimethylbenzene-1,3,5-triamine hydrochloride
- Molecular formula
- C8H14ClN3
- Molecular weight
- 187.66986
Names & synonyms
2,6-Dimethylbenzene-1,3,5-triamine hydrochloride94135-20-3N2V4TDF9L3EINECS 302-889-3UNII-N2V4TDF9L3DTXSID00240747HUPRNZLUDKGPHB-UHFFFAOYSA-NNS000921842,4-Dimethylbenzene-1,3,5-triamine--hydrogen chloride (1/1)2,6-Dimethyl-1,3,5-benzenetriamine/hydrochloric acid,(1:x)
Database identifiers
- CAS
94135-20-3- PubChem CID
- 6366456
- DTXSID
DTXSID00240747- UNII
- N2V4TDF9L3
- EC Number
- 302-889-3
Properties
Computed structural properties
- Topological polar surface area
- 78.1 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 123
Physicochemical properties
- FDA UNII
- 2 V4TDF9L3 · N2V4TDF9L3
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Compound notes
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