Benzyl 2-O-(4-methylbenzene-1-sulfonyl)pentopyranoside
Basic information
- CAS
50256-95-6- Standard SMILES
Cc1ccc(S(=O)(=O)OC2C(OCc3ccccc3)OCC(O)C2O)cc1- InChIKey
BCCUYJAJLVFEBJ-UHFFFAOYSA-N- Molecular formula
- C19H22O7S
- Average molar mass
- 394.4 g/mol
- Monoisotopic mass
- 394.10862421
Names & identifiers
- Preferred name
- Benzyl 2-O-(4-methylbenzene-1-sulfonyl)pentopyranoside
- IUPAC
- (4,5-dihydroxy-2-phenylmethoxyoxan-3-yl) 4-methylbenzenesulfonate
Names & synonyms
50256-95-6NSC356145Benzyl 2-O-(4-methylbenzene-1-sulfonyl)pentopyranosideDTXSID50964547NSC-3561456679-71-6
Database identifiers
- CAS
50256-95-6- PubChem CID
- 337579
- DTXSID
DTXSID50964547
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 547
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…