Basic information
- CAS
260804-64-6- Standard SMILES
OC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OCC3CCCCC3)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O- InChIKey
BBUKPWNPDDHXDR-CRINDFDSSA-N- Molecular formula
- C19H34O11
- Average molar mass
- 438.5 g/mol
- Monoisotopic mass
- 438.2101119
Names & identifiers
- Preferred name
- Cyclohexylmethyl 4-O-alpha-D-glucopyranosyl-beta-D-glucopyranoside
- IUPAC
- (2R,3R,4S,5S,6R)-2-[(2R,3S,4R,5R,6R)-6-(cyclohexylmethoxy)-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
- English name
- CYCLOHEXYLMETHYL--D-MALTOSIDE 500M
- Molecular formula
- C19H34O11
- Molecular weight
- 438.47
Names & synonyms
260804-64-6DTXSID70435168Cyclohexylmethyl 4-O-alpha-D-glucopyranosyl-beta-D-glucopyranosideRefChem:335769DTXCID90385994Cyclohexylmethyl-4-O-(a-D-glucopyranosyl)-b-D-glucopyranosideCYCLOHEXYLMETHYL-4-O-(A-D-GLUCOPYRANOSYL)-BETA-D-GLUCOPYRANOSIDE(2R,3R,4S,5S,6R)-2-[(2R,3S,4R,5R,6R)-6-(cyclohexylmethoxy)-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol(2~{R},3~{R},4~{S},5~{S},6~{R})-2-[(2~{R},3~{S},4~{R},5~{R},6~{R})-6-(cyclohexylmethoxy)-2-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol(2R,3R,4S,5S,6R)-2-{[(2R,3S,4R,5R,6R)-6-(CYCLOHEXYLMETHOXY)-4,5-DIHYDROXY-2-(HYDROXYMETHYL)OXAN-3-YL]OXY}-6-(HYDROXYMETHYL)OXANE-3,4,5-TRIOLCyclohexylmethyl-b-D-maltosideCymal-1
Show more names
CYMALR-1, ANAGRADEcyclohexylmethyl β-d-maltosideCyclohexyl-Methyl-β-D-MaltosideCyclohexyl-methyl-b-D-maltosideCYCLOHEXYLMETHYL--D-MALTOSIDE 500M
Properties
Computed structural properties
- XLogP
- -1.8
- Topological polar surface area
- 179 Ų
- Hydrogen bond donors
- 7
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 7
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 517
Physicochemical properties
- Boiling point
- 695.1 · 695.1±55.0 °C(Predicted)
- Density
- 1.47 · 1.47±0.1 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 12.89 · 12.89±0.70(Predicted)
- Safety Statements
- 22 · 22-24/25
- WGK Germany
- 3 · 3
- F
- 10 · 10-21
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
- F
- 10-21
- wgk
- 3
- safety_code
- 22-24/25
Chemistry & industry
Suppliers9 total
阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]
BOC Sciences16314854226 · [email protected]
资川生化科技(苏州)有限公司0512-66317708 13372112871 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
武汉福鑫化工有限公司+86-2759207851; +86-18007136271 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
深圳市丽晶生化科技有限公司0755-85201366 18938635012 · [email protected]
Aladdin Scientific[email protected]
资川生化科技(苏州)有限公司0512-66317708 13372112871 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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