CAS No.15548-61-5,6-BROMO-2-NAPHTHYL-BETA-D-GLUCOPYRANOSIDE Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	15548-61-5
Name:	6-BROMO-2-NAPHTHYL-BETA-D-GLUCOPYRANOSIDE

Formula:	C₁₆H₁₇BrO₆
Molecular Weight:	385.211
Synonyms:	Glucopyranoside,6-bromo-2-naphthyl, b-D- (7CI,8CI);6-Bromo-2-naphthyl b-D-glucopyranoside;6-Bromo-2-naphthyl-b-D-glucoside;
EINECS:	239-604-6
Density:	1.698 g/cm³
Melting Point:	210-212 °C
Boiling Point:	608.6 °C at 760 mmHg
Flash Point:	321.9 °C
Solubility:	Soluble in DMF (1% w/v)
Appearance:	white to light yellow crystal powder
Safety:	24/25
PSA:	99.38000
LogP:	0.78100

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Specification

The β-D-Glucopyranoside,6-bromo-2-naphthalenyl, with the CAS registry number 15548-61-5, is also known as 6-Bromo-2-naphthyl β-D-glucopyranoside. It belongs to the product category of Substrates. Its EINECS registry number is 239-604-6. This chemical's molecular formula is C₁₆H₁₇BrO₆ and molecular weight is 385.20658. Its IUPAC name is called (2S,3R,4S,5S,6R)-2-(6-bromonaphthalen-2-yl)oxy-6-(hydroxymethyl)oxane-3,4,5-triol. When you are using this chemical, please be cautious about it. You must avoid contacting it with skin and eyes.

Physical properties of β-D-Glucopyranoside,6-bromo-2-naphthalenyl: (1)ACD/LogP: 1.33; (2)ACD/LogD (pH 5.5): 1.33; (3)ACD/LogD (pH 7.4): 1.33; (4)ACD/BCF (pH 5.5): 6.07; (5)ACD/BCF (pH 7.4): 6.07; (6)ACD/KOC (pH 5.5): 126.52; (7)ACD/KOC (pH 7.4): 126.51; (8)#H bond acceptors: 6; (9)#H bond donors: 4; (10)#Freely Rotating Bonds: 7; (11)Index of Refraction: 1.698; (12)Molar Refractivity: 87.49 cm³; (13)Molar Volume: 226.8 cm³; (14)Surface Tension: 68 dyne/cm; (15)Density: 1.698 g/cm³; (16)Flash Point: 321.9 °C; (17)Enthalpy of Vaporization: 95.08 kJ/mol; (18)Boiling Point: 608.6 °C at 760 mmHg; (19)Vapour Pressure: 1.15E-15 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC2=C(C=CC(=C2)Br)C=C1OC3C(C(C(C(O3)CO)O)O)O
(2)Isomeric SMILES: C1=CC2=C(C=CC(=C2)Br)C=C1O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O
(3)InChI: InChI=1S/C16H17BrO6/c17-10-3-1-9-6-11(4-2-8(9)5-10)22-16-15(21)14(20)13(19)12(7-18)23-16/h1-6,12-16,18-21H,7H2/t12-,13-,14+,15-,16-/m1/s1
(4)InChIKey: NLRXQZJJCPRATR-IBEHDNSVSA-N