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2,2,2-Trichloroethyl beta-D-Glucopyranosiduronic Acid
[CAS# 97-25-6]

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Identification
Name 2,2,2-Trichloroethyl beta-D-Glucopyranosiduronic Acid
Synonyms (2S,3S,4S,5R,6R)-3,4,5-Trihydroxy-6-(2,2,2-Trichloroethoxy)Tetrahydropyran-2-Carboxylic Acid; (2S,3S,4S,5R,6R)-3,4,5-Trihydroxy-6-(2,2,2-Trichloroethoxy)-2-Tetrahydropyrancarboxylic Acid; Uca
Molecular Structure CAS#: 97-25-6, 2,2,2-Trichloroethyl beta-D-Glucopyranosiduronic Acid
Molecular Formula C8H11Cl3O7
Molecular Weight 325.53
CAS Registry Number 97-25-6
SMILES [C@H]1(OCC(Cl)(Cl)Cl)[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)C(=O)O
InChI 1S/C8H11Cl3O7/c9-8(10,11)1-17-7-4(14)2(12)3(13)5(18-7)6(15)16/h2-5,7,12-14H,1H2,(H,15,16)/t2-,3-,4+,5-,7+/m0/s1
InChIKey IQOASJJGUQMXDW-GHQVIJFQSA-N
Properties
Density 1.807g/cm3 (Cal.)
Boiling point 545.209°C at 760 mmHg (Cal.)
Flash point 283.532°C (Cal.)
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