4-[(e)-Phenyldiazenyl]phenyl 2,3,4,6-tetra-o-propanoylhexopyranoside
Basic information
- CAS
6291-09-4- Standard SMILES
CCC(=O)OCC1OC(Oc2ccc(N=Nc3ccccc3)cc2)C(OC(=O)CC)C(OC(=O)CC)C1OC(=O)CC- InChIKey
AMSVXLPPAZFKDC-UHFFFAOYSA-N- Molecular formula
- C30H36N2O10
- Average molar mass
- 584.6 g/mol
- Monoisotopic mass
- 584.23699535
Names & identifiers
- Preferred name
- 4-[(e)-Phenyldiazenyl]phenyl 2,3,4,6-tetra-o-propanoylhexopyranoside
- IUPAC
- [6-(4-phenyldiazenylphenoxy)-3,4,5-tri(propanoyloxy)oxan-2-yl]methyl propanoate
Names & synonyms
6291-09-4NSC42354-[(e)-phenyldiazenyl]phenyl 2,3,4,6-tetra-o-propanoylhexopyranosideDTXSID20277792NSC-4235
Database identifiers
- CAS
6291-09-4- PubChem CID
- 220830
- DTXSID
DTXSID20277792
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 148 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 17
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 914
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Compound notes
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