CAS No.38597-12-5,4-METHYLUMBELLIFERYL-ALPHA-D-GALACTOPYRANOSIDE Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	38597-12-5
Name:	4-METHYLUMBELLIFERYL-ALPHA-D-GALACTOPYRANOSIDE
Article Data:	4

Formula:	C₁₆H₁₈O₈
Molecular Weight:	338.314
Synonyms:	4-Methylumbelliferonea-D-galactopyranoside;4-Methylumbelliferyl a-D-galactopyranoside;4-Methylumbelliferyl a-D-galactoside;4-Methylumbelliferyl a-galactoside;
EINECS:	254-031-1
Density:	1.522 g/cm³
Melting Point:	171-173 °C
Boiling Point:	626.9 °C at 760 mmHg
Flash Point:	233.9 °C
Solubility:	H₂O: 10 mg/mL hot, clear, colorless
Appearance:	white to almost white crystalline powder
Hazard Symbols:	T+
Risk Codes:	26/27/28
Safety:	24/25
PSA:	129.59000
LogP:	-0.71990

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Specification

The 2H-1-Benzopyran-2-one,7-(α-D-galactopyranosyloxy)-4-methyl-, with CAS registry number 38597-12-5, belongs to the following product categories: Substrates;13C & 2H Sugars; Carbohydrates & Derivatives; Fluorescent Labels & Indicators; Galactosidase, alphaResearch Essentials; Galactoside;Alphabetical Substrates; Core Bioreagents; Fluorescent Enzyme Substrates; Fluorescent Probes, Labels, Particles and Stains; FluorogenicEnzyme Substrates; Substrates by Enzyme. It has the systematic name of 4-methyl-2-oxo-2H-chromen-7-yl α-D-galactopyranoside. This chemical is a kind of off-white solid. And this chemical should be stored at the temperature of 2-8°C. What's more, its EINECS is 254-031-1.

Physical properties of 2H-1-Benzopyran-2-one,7-(α-D-galactopyranosyloxy)-4-methyl-: (1)ACD/LogP: -0.46; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.46; (4)ACD/LogD (pH 7.4): -0.46; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 13.32; (8)ACD/KOC (pH 7.4): 13.32; (9)#H bond acceptors: 8; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 81.68 Å²; (13)Index of Refraction: 1.641; (14)Molar Refractivity: 80.17 cm³; (15)Molar Volume: 222.1 cm³; (16)Polarizability: 31.78×10^-24cm³; (17)Surface Tension: 73.1 dyne/cm; (18)Density: 1.522 g/cm³; (19)Flash Point: 233.9 °C; (20)Enthalpy of Vaporization: 97.54 kJ/mol; (21)Boiling Point: 626.9 °C at 760 mmHg; (22)Vapour Pressure: 1.39E-16 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The 2H-1-Benzopyran-2-one,7-(α-D-galactopyranosyloxy)-4-methyl- is very toxic by inhalation, in contact with skin and if swallowed. When use it, avoid contact with skin and eyes.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C/2Oc3cc(O[C@H]1O[C@@H]([C@H](O)[C@H](O)[C@H]1O)CO)ccc3\C(=C\2)C
(2)InChI: InChI=1/C16H18O8/c1-7-4-12(18)23-10-5-8(2-3-9(7)10)22-16-15(21)14(20)13(19)11(6-17)24-16/h2-5,11,13-17,19-21H,6H2,1H3/t11-,13+,14+,15-,16+/m1/s1
(3)InChIKey: YUDPTGPSBJVHCN-CHUNWDLHBS
(4)Std. InChI: InChI=1S/C16H18O8/c1-7-4-12(18)23-10-5-8(2-3-9(7)10)22-16-15(21)14(20)13(19)11(6-17)24-16/h2-5,11,13-17,19-21H,6H2,1H3/t11-,13+,14+,15-,16+/m1/s1
(5)Std. InChIKey: YUDPTGPSBJVHCN-CHUNWDLHSA-N