Butyl alpha-D-mannopyranoside
Basic information
- CAS
146453-36-3- Standard SMILES
CCCCO[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O- InChIKey
BZANQLIRVMZFOS-ZJDVBMNYSA-N- Molecular formula
- C10H20O6
- Average molar mass
- 236.26 g/mol
- Monoisotopic mass
- 236.12598835
Names & identifiers
- Preferred name
- Butyl alpha-D-mannopyranoside
- IUPAC
- (2S,3S,4S,5S,6R)-2-butoxy-6-(hydroxymethyl)oxane-3,4,5-triol
Names & synonyms
BUTYL ALPHA-D-MANNOPYRANOSIDE1uwfBUTYLALPHAMAN1tr7Butyl I+/--D-mannopyranosideSCHEMBL2446734CHEMBL1170454DTXSID601312204146453-36-3Q27459191BUTYL-A-D-MANNOSE; butyl alpha-D-mannoside; butyl D-mannoside; butyl mannoside
Database identifiers
- CAS
146453-36-3- PubChem CID
- 656941
- DTXSID
DTXSID601312204- ChEMBL
CHEMBL1170454- Nikkaji
- J2.407.335A
Properties
Computed structural properties
- XLogP
- -0.9
- Topological polar surface area
- 99.4 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 200
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…