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| CAS No.: | 2816-24-2 |
|---|---|
| Name: | 2-NITROPHENYL-BETA-D-GLUCOPYRANOSIDE |
| Article Data: | 15 |
| Molecular Structure: | |
|
|
|
| Formula: | C12H15NO8 |
| Molecular Weight: | 301.253 |
| Synonyms: | Glucopyranoside,o-nitrophenyl, b-D-(7CI,8CI);2-Nitrophenyl b-D-glucopyranoside;2-Nitrophenyl b-D-glucoside;o-Nitrophenyl b-D-glucopyranoside;o-Nitrophenylb-D-glucoside;o-Nitrophenyl b-glucoside; |
| EINECS: | 220-568-5 |
| Density: | 1.599 g/cm3 |
| Melting Point: | 141-142℃ |
| Boiling Point: | 572.4 °C at 760 mmHg |
| Flash Point: | 300 °C |
| Solubility: | Soluble in water |
| Appearance: | white to yellow powder |
| Hazard Symbols: |
 Xi
|
| Risk Codes: | 36/37/38 |
| Safety: | 22-24/25-36-26 |
| PSA: | 145.20000 |
| LogP: | -0.70330 |
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Chemistry
Molecular Structure of b-D-Glucopyranoside, 2-nitrophenyl (CAS NO.2816-24-2):
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IUPAC Name: (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(2-nitrophenoxy)oxane-3,4,5-triol
Empirical Formula: C12H15NO8
Molecular Weight: 301.2494
H bond acceptors: 9
H bond donors: 4
Freely Rotating Bonds: 8
Polar Surface Area: 101.2 Å2
Index of Refraction: 1.647
Molar Refractivity: 68.5 cm3
Molar Volume: 188.3 cm3
Surface Tension: 74.1 dyne/cm
Density: 1.599 g/cm3
Flash Point: 300 °C
Enthalpy of Vaporization: 90.27 kJ/mol
Boiling Point: 572.4 °C at 760 mmHg
Vapour Pressure: 6.1E-14 mmHg at 25°C
Storage temp: 2-8°C
Form: powder
Color: light yellow
BRN: 92206
InChI
InChI=1/C12H15NO8/c14-5-8-9(15)10(16)11(17)12(21-8)20-7-4-2-1-3-6(7)13(18)19/h1-4,8-12,14-17H,5H2/t8-,9-,10+,11-,12-/m1/s1
Smiles
O=[N+]([O-])c1ccccc1O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](CO)O1
EINECS: 220-568-5
Product Categories: Substrates; Glucosidase, beta-; Enzyme Substrates; Substrates by Enzyme; Glucoside;Activity; Chromogenic; ChromogenicSubstrates
Safety Profile
Hazard Codes: 
Xi
Risk Statements: 36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 22-24/25-36-26
S22:Do not breathe dust.
S24/25:Avoid contact with skin and eyes.
S36:Wear suitable protective clothing.
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
WGK Germany: 3
F: 3-10-21
Specification
b-D-Glucopyranoside, 2-nitrophenyl , with CAS number of 2816-24-2, can be called 2-Nitrophenyl .beta.-D-glucopyranoside ; beta-D-Glucopyranoside, 2-nitrophenyl (9CI) ; o-Nitrophenyl .beta.-D-glucopyranoside ; o-Nitrophenyl beta-D-glucopyranoside .