CAS No.915411-01-7,1H-INDAZOL-7-YL BORONIC ACID Suppliers

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Basic Information

Molecular Structure:
CAS No.:	915411-01-7
Name:	1H-INDAZOL-7-YL BORONIC ACID
Article Data:	3

Formula:	C₇H₇BN₂O₂
Molecular Weight:	161.956
Synonyms:	Boronic acid, B-1H-indazol-7-yl-;
Density:	1.42 g/cm³
Boiling Point:	457 °C at 760 mmHg
Flash Point:	230.2 °C
PSA:	69.14000
LogP:	-0.75730

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Specification

The 1H-Indazole-7-boronic acid, with the CAS registry number of 915411-01-7, is also known as Boronic acid, B-1H-indazol-7-yl-. It belongs to the product categories of Indazole; Organoborons. This chemical's molecular formula is C₇H₇BN₂O₂ and molecular weight is 151.0.

Physical properties about the are: (1)ACD/LogP: 1.19; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.19; (4)ACD/LogD (pH 7.4): 1.12; (5)#H bond acceptors: 4; (6)#H bond donors: 3; (7)#Freely Rotating Bonds: 3; (8)Polar Surface Area: 69.14 Å²; (9)Index of Refraction: 1.671; (10)Molar Refractivity: 42.56 cm³; (11)Molar Volume: 113.8 cm³; (12)Surface Tension: 73.7 dyne/cm; (13)Density: 1.42 g/cm³; (14)Flash Point: 230.2 °C; (15)Enthalpy of Vaporization: 75.56 kJ/mol; (16)Boiling Point: 457 °C at 760 mmHg; (17)Vapour Pressure: 3.81E-09 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: B(c1cccc2c1[nH]nc2)(O)O
(2) InChI: InChI=1/C7H7BN2O2/c11-8(12)6-3-1-2-5-4-9-10-7(5)6/h1-4,11-12H,(H,9,10)
(3) InChIKey: QAHHYPPRKWNXHT-UHFFFAOYAA