Basic information
- CAS
52868-78-7- Standard SMILES
C[NH+](C)CC(O)C(O)C(O)C(O)C[NH+](C)C.[Cl-].[Cl-]- InChIKey
YWFVWMXNUFKWCI-UHFFFAOYSA-N- Molecular formula
- C10H26Cl2N2O4
- Average molar mass
- 309.23 g/mol
- Monoisotopic mass
- 308.1269627
Names & identifiers
- Preferred name
- 1,6-Dideoxy-1,6-bis(dimethylamino)hexitol--hydrogen chloride (1/2)
- IUPAC
- [6-(dimethylazaniumyl)-2,3,4,5-tetrahydroxyhexyl]-dimethylazanium dichloride
Names & synonyms
52868-78-7DTXSID509673311,6-Dideoxy-1,6-bis(dimethylamino)hexitol--hydrogen chloride (1/2)RefChem:1053503DTXCID001394931MANNITOL, 1,6-BIS(DIMETHYLAMINO)-, D-, DIHYDROCHLORIDEDimethylamino-1,6 D-mannitol dihydrochloride
Database identifiers
- CAS
52868-78-7- PubChem CID
- 40563
Properties
Computed structural properties
- Topological polar surface area
- 89.8 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 170
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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