p-Tolyl 2,3,4-tri-O-acetyl-a-L-rhamnopyranoside
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Basic information
- CAS
620951-70-4- Standard SMILES
CC(=O)O[C@@H]1[C@@H](OC(C)=O)[C@H](C)O[C@@H](Sc2ccc(C)cc2)[C@@H]1OC(C)=O- InChIKey
IUPHPIKXHZLVMM-RNTHYAPCSA-N- Molecular formula
- C19H24O7S
- Average molar mass
- 396.5 g/mol
- Monoisotopic mass
- 396.12427427
Names & identifiers
- Preferred name
- p-Tolyl 2,3,4-tri-O-acetyl-a-L-rhamnopyranoside
- IUPAC
- [(2S,3S,4R,5R,6S)-4,5-diacetyloxy-2-methyl-6-(4-methylphenyl)sulfanyloxan-3-yl] acetate
- English name
- P-Tolyl 2,3,4-tri-O-acetyl-1-thio-α-l-rhamnopyranoside
- Molecular formula
- C19H24O7S
- Molecular weight
- 396.45
Names & synonyms
620951-70-4P-Tolyl 2,3,4-tri-O-acetyl-1-thio-alpha-l-rhamnopyranoside(2S,3S,4R,5R,6S)-2-Methyl-6-(p-tolylthio)tetrahydro-2H-pyran-3,4,5-triyl triacetatep-Tolyl 2,3,4-tri-O-acetyl-a-L-rhamnopyranosideC19H24O7SCS-0093267[(2S,3S,4R,5R,6S)-4,5-diacetoxy-2-methyl-6-(p-tolylsulfanyl)tetrahydropyran-3-yl] acetateP-Tolyl 2,3,4-tri-O-acetyl-1-thio-α-l-rhamnopyranoside4-Methylphenyl 2,3,4-tri-O-acetyl-1-thio-α-L-rhamnopyranosideα-L-Mannopyranoside, 4-methylphenyl 6-deoxy-1-thio-, 2,3,4-triacetate
Database identifiers
- CAS
620951-70-4- PubChem CID
- 11749820
- Nikkaji
- J1.965.957G
Properties
Computed structural propertiesFilling in
- XLogP
- 2.9
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 8
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 544
Physicochemical properties
- Melting point
- 111 · 111-112 °C
- Boiling point
- 468.3 · 468.3±45.0 °C(Predicted)
- Density
- 1.25 · 1.25±0.1 g/cm3(Predicted)
- HS Code
- 2938909090 · 2938909090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2938909090
Related reactions
0 records
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Compound notes
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