ChemicalBook--->CAS DataBase List--->1464-44-4

1464-44-4

1464-44-4 Structure

1464-44-4 Structure
IdentificationMore
[Name]

PHENYL-BETA-D-GLUCOPYRANOSIDE
[CAS]

1464-44-4
[Synonyms]

PH-BETA-D-GLC
PHENYL-B-D-GLUCOPYRANOSIDE
PHENYL-B-D-GLUCOSIDE
PHENYL-BETA-D-GLUCOPYRANOSIDE
PHENYL-BETA-D-GLUCOSIDE
beta-d-glucopyranosid
beta-d-glucopyranoside,phenyl
phenolglucoside
phenyl-beta-d-glucopyranosid
phenylglucoside
PHENYL-BETA-D-GLUCOPYRANOSID 97%
PHENYL-SS-D-GLUCOPYRANOSIDE (MONOHYDRATE)
PHENYL-SS-D-GLUCOPYRANOSIDE
PHENYL-B-D-GLUCOPYRANOSIDE DIHYDRATE
1-O-Phenyl-β-D-glucopyranose
Phenyl--D-glucopyranoside (monohydrate)
[EINECS(EC#)]

215-978-6
[Molecular Formula]

C12H16O6
[MDL Number]

MFCD00064089
[Molecular Weight]

256.25
[MOL File]

1464-44-4.mol
Chemical PropertiesBack Directory
[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)
Safety DataBack Directory
[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
Hazard InformationBack Directory
[Chemical Properties]

white powder
[Uses]

Phenyl β-D-glucopyranoside can be used:
  • As a starting material for the synthesis of various derivatives of β-D-glucopyranosides with potential application as anti-HIV agents.
  • As a model for glycosides in the gas phase for their spectroscopic investigation.
  • As an internal standard in GC and GC-MS quantitative analyses.

[Definition]

ChEBI: Phenyl beta-D-glucopyranoside is a glycoside.
[Safety Profile]

Moderately toxic by intraperitoneal route. When heated to decomposition it emits acrid smoke and irritating vapors.
[Purification Methods]

Phenyl--D-glucopyranoside recrystallises from H2O with 2H2O and can be dried in vacuo at 100o/P2O5. The dry preparation has [] 25D -70.7o (c 2, H2O). [Robertson & Waters J Chem Soc 2729 1930, IR: Bunton et al. J Chem Soc 4419 1955, Takahashi Yakugaku Zasshi (J Pharm Soc Jpn) 74 7436 1954, Whixtler & House Anal Chem 25 1463 1953, UV: Lewis J Am Chem Soc 57 898 1935.] It is a substrate for D-glucosidase [deBryne Eur J Biochem 102 257 1979]. [Beilstein 17 III/V 2946.]
Spectrum DetailBack Directory
[Spectrum Detail]

PHENYL-BETA-D-GLUCOPYRANOSIDE(1464-44-4)MS
PHENYL-BETA-D-GLUCOPYRANOSIDE(1464-44-4)1HNMR
PHENYL-BETA-D-GLUCOPYRANOSIDE(1464-44-4)13CNMR
PHENYL-BETA-D-GLUCOPYRANOSIDE(1464-44-4)IR1
PHENYL-BETA-D-GLUCOPYRANOSIDE(1464-44-4)IR2
PHENYL-BETA-D-GLUCOPYRANOSIDE(1464-44-4)IR3
PHENYL-BETA-D-GLUCOPYRANOSIDE(1464-44-4)Raman
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

1464-44-4(sigmaaldrich)
[TCI AMERICA]

Phenyl beta-D-Glucopyranoside  Hydrate,>99.0%(GC)(1464-44-4)
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