1464-44-4

Name PHENYL-BETA-D-GLUCOPYRANOSIDE
CAS 1464-44-4
EINECS(EC#) 215-978-6
Molecular Formula C12H16O6
MDL Number MFCD00064089
Molecular Weight 256.25
MOL File 1464-44-4.mol
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Chemical Properties

Appearance white powder
Melting point  176-178 °C(lit.)
Boiling point  359.49°C (rough estimate)
density  1.2993 (rough estimate)
refractive index  -70.5 ° (C=2, H2O)
storage temp.  2-8°C
solubility  Methanol (Slightly), Water (Slightly, Sonicated)
form  Powder
pka 12.70±0.70(Predicted)
color  White to Off-white
Stability: Stable. Incompatible with strong oxidizing agents.
Optical Rotation [α]25/D 70°, c = 1 in H2O
Water Solubility  Soluble in water
BRN  87517
InChI 1S/C12H16O6/c13-6-8-9(14)10(15)11(16)12(18-8)17-7-4-2-1-3-5-7/h1-5,8-16H,6H2/t8-,9-,10+,11-,12-/m1/s1
InChIKey NEZJDVYDSZTRFS-RMPHRYRLSA-N
SMILES OC[C@H]1O[C@@H](Oc2ccccc2)[C@H](O)[C@@H](O)[C@@H]1O
CAS DataBase Reference 1464-44-4(CAS DataBase Reference)
EPA Substance Registry System .beta.-D-Glucopyranoside, phenyl (1464-44-4)
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Safety Data

Hazard Codes  F,C
Safety Statements 
S16:Keep away from sources of ignition-No smoking .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
WGK Germany  3
RTECS  LZ5985510
F  3-10-21
TSCA  Yes
HS Code  29400090
Storage Class 11 - Combustible Solids
Toxicity
LD50 ipr-mus: 980 mg/kg NYKZAU49,84,53

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