Basic information
- CAS
34753-29-2- Standard SMILES
C[NH+](CCCCl)CCCCl.O=[N+]([O-])c1cc([N+](=O)[O-])c([O-])c([N+](=O)[O-])c1- InChIKey
YHGFQOOQGGTJJS-UHFFFAOYSA-N- Molecular formula
- C13H18Cl2N4O7
- Average molar mass
- 413.2 g/mol
- Monoisotopic mass
- 412.0552543
Names & identifiers
- Preferred name
- Dipropylamine, 3,3'-dichloro-N-methyl-, picrate
- IUPAC
- bis(3-chloropropyl)-methylazanium;2,4,6-trinitrophenolate
Names & synonyms
N-Methyl-3,3'-dichlorodipropylamine picrateDIPROPYLAMINE, 3,3'-DICHLORO-N-METHYL-, PICRATE3,3'-Dichloro-N-methyl-dipropylamine picrate34753-29-2DTXSID10188308RefChem:339078DTXCID001107993-Chloro-N-(3-chloropropyl)-N-methylpropan-1-aminium 2,4,6-trinitrophenolate
Database identifiers
- CAS
34753-29-2- PubChem CID
- 36907
- DTXSID
DTXSID10188308
Properties
Computed structural properties
- Topological polar surface area
- 165 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 352
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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