glucoascorbic acid ...

glucoascorbic acid 528-88-1

glucoascorbic acid 528-88-1

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1 Gram

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  • Min.Order :1 Gram
  • Purity: 99%
  • Payment Terms : L/C,T/T,

Keywords

D-arabino-Hept-2-enonic acid,ç-lactone glucoascorbic acid 528-88-1

Quick Details

  • Appearance:Solid
  • Application:Organic Chemicals
  • PackAge:as requested
  • ProductionCapacity:100|Kilogram|Month
  • Storage:Room Temperature
  • Transportation:as requested

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4.Customs Synthesis
 
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Details:

Identification and Related Records
【Name】
glucoascorbic acid
【CAS Registry number】
528-88-1
【Synonyms】
3-Keto-D-glucoheptonofuranolactone
D-Arabino-hept-2-enonic acid, .gamma.-lactone
D-Glucoascorbic acid
Glucoascorbic acid, D-
Nsc14706
【Molecular Formula】
C7H10O7 (Products with the same molecular formula)
【Molecular Weight】
0
【Inchi】
InChI=1/C7H10O7/c8-1-2(9)3(10)6-4(11)5(12)7(13)14-6/h2-3,6,8-10,12-13H,1H2/t2-,3-,6+/m1/s1
【Canonical SMILES】
C(C(C(C1C(=O)C(=C(O1)O)O)O)O)O
【Isomers smiles】
C(C(C(C1C(=O)C(=C(O1)O)O)O)O)O
Chemical and Physical Properties
【Density】
1.972g/cm3
【Boiling Point】
558.7°C at 760 mmHg
【Refractive Index】
1.722
【Flash Point】
234°C
【Computed Properties】
Molecular Weight:206.1501 [g/mol]
Molecular Formula:C7H10O7
XLogP3:-2.5
H-Bond Donor:5
H-Bond Acceptor:7
Rotatable Bond Count:3
Tautomer Count:8
Exact Mass:206.042653
MonoIsotopic Mass:206.042653
Topological Polar Surface Area:127
Heavy Atom Count:14
Formal Charge:0
Complexity:271
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:3
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:5
Feature 3D Donor Count:5
Feature 3D Ring Count:1
Effective Rotor Count:3.4
Conformer Sampling RMSD:0.6
CID Conformer Count:46

 

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