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1-O-[2-(4-Chlorophenoxy)-2-methylpropanoyl]hexopyranuronic acid

HCID 155696
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Basic information

CAS
72072-47-0
Standard SMILES
CC(C)(Oc1ccc(Cl)cc1)C(=O)O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O
InChIKey
LCJVUUVMVSSIGZ-HNRZYHPDSA-N
Molecular formula
C16H19ClO9
Average molar mass
390.772 g/mol
Monoisotopic mass
390.07175987

Names & identifiers

Preferred name
1-O-[2-(4-Chlorophenoxy)-2-methylpropanoyl]hexopyranuronic acid
IUPAC
1-O-[2-(4-Chlorophenoxy)-2-methylpropanoyl]-beta-D-glucopyranuronic acid
English name
Clofibric Acid Acyl-b-D-glucuronide
Molecular formula
C16H19ClO9
Molecular weight
390.77

Names & synonyms

Clofibryl GlucuronideValine Impurity 23-d8Clofibric -GlucuronideClofibric b-GlucuronideClofibric Acid GlucuronideClofibric Acid Acyl--D-glucuronideClofibric Acid Acyl-b-D-glucuronideClofibric acid-acyl-beta-D-GlucuronideClofibric Acid Acyl-2-D-glucuronide (90%)Clofibric Acid Acyl-β-D-glucuronide (90%)

Database identifiers

CAS
72072-47-0
PubChem CID
155696
DTXSID
DTXSID10992801
Nikkaji
J444.998C

Properties

Physicochemical properties

Melting point
56 · 56-64°C
Boiling point
587.3 · 587.3±50.0 °C(Predicted)
Density
1.55 · 1.55±0.1 g/cm3(Predicted)
storage temp.
-20 °C · Hygroscopic, -20°C Freezer, Under Inert Atmosphere
solubility
DMSO (Slightly), Methanol (Slightly), Water (Slightly)
pka
2.67 · 2.67±0.70(Predicted)
form
Solid
color
Off-White to Yellow
Stability
Very Hygroscopic, Unstable in Solution

Chemistry & industry

Applications

UsesA metabolite of Clofibric Acid.

Suppliers8 total

Clearsynth Labs Limited+91-22-26355700 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
BOC Sciences16314854226 · [email protected]
艾吉析科技(上海)有限公司17717235263 17717235263 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]

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