Cas no 1745-65-9 (a-D-Glucopyranoside,6-O-phosphono-a-D-glucopyranosyl,6-(dihydrogen phosphate))
1745-65-9 structure
Product Name:a-D-Glucopyranoside,6-O-phosphono-a-D-glucopyranosyl,6-(dihydrogen phosphate)
CAS No:1745-65-9
MF:C12H24O17P2
MW:502.256287574768
CID:207200
PubChem ID:164878
Update Time:2025-04-19
a-D-Glucopyranoside,6-O-phosphono-a-D-glucopyranosyl,6-(dihydrogen phosphate) Chemical and Physical Properties
Names and Identifiers
-
- a-D-Glucopyranoside,6-O-phosphono-a-D-glucopyranosyl,6-(dihydrogen phosphate)
- alpha,alpha-trehalose 6,6'-diphosphate
- 6-O-phosphono-alpha-D-glucopyranosyl 6-O-phosphono-alpha-D-glucopyranoside
- Trehalose 6,6'-diphosphate
- Trehalose, 6,6'-bis(dihydrogen phosphate)
- DTXSID20938518
- alpha,alpha-trehalose 6,6/'-diphosphate
- 1745-65-9
- [(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxyoxan-2-yl]methyl dihydrogen phosphate
- 6-O-Phosphonohexopyranosyl 6-O-phosphonohexopyranoside
-
- Inchi： 1S/C12H24O17P2/c13-5-3(1-25-30(19,20)21)27-11(9(17)7(5)15)29-12-10(18)8(16)6(14)4(28-12)2-26-31(22,23)24/h3-18H,1-2H2,(H2,19,20,21)(H2,22,23,24)/t3-,4-,5-,6-,7+,8+,9-,10-,11-,12-/m1/s1
- InChI Key： UKVYVCPNPMKOAO-LIZSDCNHSA-N
- SMILES： P(=O)(O)(O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@H]1[C@@H]([C@H]([C@@H]([C@@H](COP(=O)(O)O)O1)O)O)O)O)O)O
Computed Properties
- Exact Mass: 502.04882
- Monoisotopic Mass: 502.049
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 10
- Hydrogen Bond Acceptor Count: 17
- Heavy Atom Count: 31
- Rotatable Bond Count: 8
- Complexity: 624
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 10
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -7.5
- Topological Polar Surface Area: 283?2
Experimental Properties
- Density: 1.99
- Boiling Point: 894.5°Cat760mmHg
- Flash Point: 494.8°C
- Refractive Index: 1.642
- PSA: 282.59
a-D-Glucopyranoside,6-O-phosphono-a-D-glucopyranosyl,6-(dihydrogen phosphate) Related Literature
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R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
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José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
-
Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
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5. An investigation of the electrochemical delithiation process of carbon coated α-Fe2O3nanoparticlesAdrian Brandt,Florian Winter,Sebastian Klamor,Frank Berkemeier,Jatinkumar Rana,Rainer P?ttgen,Andrea Balducci J. Mater. Chem. A, 2013,1, 11229-11236
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