4-Phenyl-3,5,10,11-tetraoxatricyclo[6.2.1.02,6]undecan-7-ol
Basic information
- CAS
5349-10-0- Standard SMILES
OC1C2COC(O2)C2OC(c3ccccc3)OC12- InChIKey
JOPKJLNPGQZOJZ-UHFFFAOYSA-N- Molecular formula
- C13H14O5
- Average molar mass
- 250.25 g/mol
- Monoisotopic mass
- 250.08412354
Names & identifiers
- Preferred name
- 4-Phenyl-3,5,10,11-tetraoxatricyclo[6.2.1.02,6]undecan-7-ol
- IUPAC
- 4-phenyl-3,5,10,11-tetraoxatricyclo[6.2.1.02,6]undecan-7-ol
- English name
- 1,6-Anhydro-2-O,3-O-benzylidene-β-D-mannopyranose
- Molecular formula
- C13H14O5
- Molecular weight
- 250.25
Names & synonyms
MLS002637567NSC13835349-10-04-phenyl-3,5,10,11-tetraoxatricyclo[6.2.1.0~2,6~]undecan-7-olDTXSID20277257NSC-1383SMR0015470981,3-O-BENZYLIDENE-.BETA.-D-MANNOPYRANOSE1,6-ANHYDRO-2,3-O-BENZYLIDENE-.BETA.-D-MANNOPYRANOSE4-Phenyl-3,5,10,11-tetraoxa-tricyclo[6.2.1.02,6]undecan-7-ol1,6-Anhydro-2-O,3-O-benzylidene-β-D-mannopyranoseβ-D-Mannopyranose, 1,6-anhydro-2,3-O-(phenylmethylene)-
Database identifiers
- CAS
5349-10-0- PubChem CID
- 219723
- DTXSID
DTXSID20277257
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 57.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 317
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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