17685-04-0

Name ETHYL B-D-GLUCURONIDE
CAS 17685-04-0
EINECS(EC#) 200-659-6
Molecular Formula C8H14O7
MDL Number MFCD09037574
Molecular Weight 222.193
MOL File 17685-04-0.mol
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Chemical Properties

Appearance Off-White Solid
Melting point  160-161°C
Boiling point  460.0±45.0 °C(Predicted)
density  1.52±0.1 g/cm3(Predicted)
Fp  9℃
storage temp.  Hygroscopic, -20°C Freezer, Under Inert Atmosphere
solubility  Methanol (Sparingly), Water (Slightly)
form  Solid
pka 2.84±0.70(Predicted)
color  White to Light Beige
Stability: Very Hygroscopic
InChI InChI=1/C8H14O7/c1-2-14-8-5(11)3(9)4(10)6(15-8)7(12)13/h3-6,8-11H,2H2,1H3,(H,12,13)/t3-,4-,5+,6-,8+/s3
InChIKey IWJBVMJWSPZNJH-UJTYWHTDNA-N
SMILES [C@@H]1(C(O)=O)[C@@H](O)[C@H](O)[C@@H](O)[C@H](OCC)O1 |&1:0,4,6,8,10,r|
CAS DataBase Reference 17685-04-0
EPA Substance Registry System .beta.-D-Glucopyranosiduronic acid, ethyl (17685-04-0)

Safety Data

Hazard Codes  F,T
Risk Statements 
Safety Statements 
RIDADR  UN1230 - class 3 - PG 2 - Methanol, solution
WGK Germany  1
HS Code  38220090

Hazard Information

Spectrum Detail

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