4-Nitrophenyl 2,3,6-tri-O-acetyl-4-O-(2,3,4,6-tetra-O-acetyl-beta-D-galactopyranosyl)-beta-D-glucopyranoside
Basic information
- CAS
84034-75-3- Standard SMILES
CC(=O)OC[C@H]1O[C@@H](O[C@H]2[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H](Oc3ccc([N+](=O)[O-])cc3)O[C@@H]2COC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O- InChIKey
NAPXHRWKTGFZTP-TZDACTGUSA-N- Molecular formula
- C32H39NO20
- Average molar mass
- 757.6 g/mol
- Monoisotopic mass
- 757.20654263
Names & identifiers
- Preferred name
- 4-Nitrophenyl 2,3,6-tri-O-acetyl-4-O-(2,3,4,6-tetra-O-acetyl-beta-D-galactopyranosyl)-beta-D-glucopyranoside
- IUPAC
- [(2R,3R,4S,5R,6S)-4,5-diacetyloxy-6-(4-nitrophenoxy)-3-[(2S,3R,4S,5S,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]methyl acetate
- English name
- 4-Nitrophenyl hepta-O-acetyl-beta-lactos
- Molecular formula
- C32H39NO20
- Molecular weight
- 757.647
Names & synonyms
84034-75-3DTXSID507453984-Nitrophenyl 2,3,6-tri-O-acetyl-4-O-(2,3,4,6-tetra-O-acetyl-beta-D-galactopyranosyl)-beta-D-glucopyranosideRefChem:295093DTXCID806961424-Nitrophenyl hepta-O-acetyl-b-lactosidep-Nitrophenyl b-D-Lactopyranoside Heptaacetate(2R,3S,4S,5R,6S)-2-(Acetoxymethyl)-6-(((2R,3R,4S,5R,6S)-4,5-diacetoxy-2-(acetoxymethyl)-6-(4-nitrophenoxy)tetrahydro-2H-pyran-3-yl)oxy)tetrahydro-2H-pyran-3,4,5-triyl triacetate4-Nitrophenyl 4-O-(2,3,4,6-Tetra-O-acetyl-beta-D-galactopyranosyl)-beta-D-glucopyranoside 2,3,6-Triacetate;p-Nitrophenyl beta-D-Lactopyranoside HeptaacetateEN04998[(2R,3R,4S,5R,6S)-4,5-diacetyloxy-6-(4-nitrophenoxy)-3-[(2S,3R,4S,5S,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]methyl acetate
Show more names
Propyl β-D-lactosidep-Nitrophenyl β-Lactoside Heptaacetate4-Nitrophenylhepta-O-acetyl-b-lactoside4-Nitrophenyl heptα-O-acetyl-β-lactoside
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 267 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 20
- Rotatable bonds
- 20
- Heavy atoms
- 53
- Formal charge
- 0
- Complexity
- 1,360
Physicochemical properties
- Boiling point
- 761.1 · 761.1±60.0 °C(Predicted)
- Density
- 1.41 · 1.41±0.1 g/cm3(Predicted)
- storage temp.
- 20 °C · −20°C
- solubility
- Methanol
- form
- Solid
- color
- White
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- Safety Statements
- 22 · 22-24/25
- WGK Germany
- 3 · 3
- HS Code
- 29400090 · 29400090
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
- wgk
- 3
- hs_code
- 29400090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 22-24/25
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Applications
Usesp-Nitrophenyl β-D-Lactopyranoside Heptaacetate (cas# 84034-75-3) is a compound useful in organic synthesis.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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