Basic information
- CAS
18375-59-2- Standard SMILES
CCCCCCNC(=O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO- InChIKey
WMZPVFOBKVXTGO-CHWFTXMASA-N- Molecular formula
- C12H25NO6
- Average molar mass
- 279.33 g/mol
- Monoisotopic mass
- 279.16818752
Names & identifiers
- Preferred name
- N-Hexyl-D-gluconamide
- IUPAC
- (2R,3S,4R,5R)-N-hexyl-2,3,4,5,6-pentahydroxyhexanamide
- English name
- N-hexyl-D-gluconamide
- Molecular formula
- C12H25NO6
- Molecular weight
- 279.33
Names & synonyms
N-Hexyl-D-gluconamide18375-59-2EINECS 242-253-1RefChem:163469242-253-1(2R,3S,4R,5R)-N-hexyl-2,3,4,5,6-pentahydroxyhexanamideN-hexyl-gluconamideSCHEMBL3624841WMZPVFOBKVXTGO-CHWFTXMASA-NDTXSID501314788NS00052073D-Gluconamide, N-hexyl-
Database identifiers
- CAS
18375-59-2- PubChem CID
- 87608
- DTXSID
DTXSID501314788- EC Number
- 242-253-1
- Nikkaji
- J266.143H
Properties
Computed structural properties
- XLogP
- -1.3
- Topological polar surface area
- 130 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 250
Physicochemical properties
- Boiling point
- 629.1 · 629.1±55.0 °C(Predicted)
- Density
- 1.26 · 1.260±0.06 g/cm3(Predicted)
- pka
- 12.49 · 12.49±0.20(Predicted)
Chemistry & industry
Suppliers1 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…