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Methyl 4,6-dichloro-4,6-dideoxy-alpha-galactopyranoside

HCID 193402
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Basic informationOverviewNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
4990-82-3
Standard SMILES
CO[C@H]1O[C@H](CCl)[C@H](Cl)[C@H](O)[C@H]1O
InChIKey
VPDVIMQPZYMQKN-PZRMXXKTSA-N
Molecular formula
C7H12Cl2O4
Average molar mass
231.07 g/mol
Monoisotopic mass
230.0112642

Overview

inhibitor of sweet response in gerbills

Names & identifiers

Preferred name
Methyl 4,6-dichloro-4,6-dideoxy-alpha-galactopyranoside
IUPAC
(2S,3R,4R,5R,6R)-5-chloro-6-(chloromethyl)-2-methoxyoxane-3,4-diol
English name
methyl 4,6-dichloro-4,6-dideoxy-alpha-galactopyranoside
Molecular formula
C7H12Cl2O4
Molecular weight
231.07

Names & synonyms

4990-82-3MDDGPMethyl 4,6-dichloro-4,6-dideoxy-alpha-galactopyranosidealpha-D-Galactopyranoside, methyl 4,6-dichloro-4,6-dideoxy-RefChem:157542(2S,3R,4R,5R,6R)-5-chloro-6-(chloromethyl)-2-methoxyoxane-3,4-diolMethyl 4,6-dichloro-4,6-dideoxy-a-D-galactopyranosidemethyl 4,6-dichloro-4,6-dideoxy-alpha-d-galactopyranosideMFCD08457713C7H12Cl2O4SCHEMBL352783DTXSID60964472
Show more names
Methyl 4,6-dichloro-4,6-dideoxy-α-D-galactopyranosideα-D-Galactopyranoside, methyl 4,6-dichloro-4,6-dideoxy-Methyl 4,6-dichloro-4,6-dideoxy-alpha-D-galactopyranoside, Min. 98%
VPDVIMQPZYMQKN-PZRMXXKTSA-NMM08882(2S,3R,4R,5R,6R)-5-Chloro-6-(chloromethyl)-2-methoxytetrahydro-2H-pyran-3,4-diolSY461716Methyl 4,6-dichloro-4,6-dideoxyhexopyranosidemethyl 4,6-dideoxy-4,6-dichloro-a-D-galactopyranosideMethyl 4-6-dichloro-4-6-dideoxy-alpha-D-galactopyranoside(2S,3R,4R,5R,6R)-5-chloro-6-(chloromethyl)-2-methoxy-tetrahydropyran-3,4-diol

Properties

Computed structural properties

XLogP
-0.1
Topological polar surface area
58.9 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
13
Formal charge
0
Complexity
169

Physicochemical properties

Melting point
157 °C · 157 °C
Boiling point
389.5 · 389.5±42.0 °C(Predicted)
Density
1.44 · 1.44±0.1 g/cm3(Predicted)
pka
12.5 · 12.50±0.70(Predicted)

Chemistry & industry

Upstream & downstream products

Upstream raw materials

alpha-D-Methylglucoside

Suppliers6 total

南京世洲生物科技有限公司025-025-85560043 17301488900 · [email protected]
上海赛可锐生物科技有限公司021-58000709 13120558703 · [email protected]
上海维亦特生物科技有限公司15317051735 · [email protected]
南京世洲生物科技有限公司13675144456 · [email protected]
上海贝万塔生物科技有限公司021-67187366 19901745723 · [email protected]
上海甄准生物科技有限公司18019219489 18901678489 · [email protected]

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes

Database identifiers

CAS
4990-82-3
PubChem CID
193402
DTXSID
DTXSID60964472
Nikkaji
J928.976C