Benzenamine,2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)- supplier

Name
3-AMINO-4-CHLOROPHENYLBORONIC ACID, PINACOL ESTER
EINECS
CAS No. 850567-56-5
Article Data3
CAS DataBase
Density 1.15 g/cm³
Solubility
Melting Point 142-144 ºC
Formula C₁₂H₁₇BClNO₂
Boiling Point 361.5°C at 760 mmHg
Molecular Weight 253.536
Flash Point 172.4°C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms 2-Chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline;3-Amino-4-chlorophenylboronic acid, pinacol ester;
PSA 44.48000
LogP 2.80260

Benzenamine,2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)- Specification

The Benzenamine,2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, with the CAS registry number 850567-56-5, is also known as 3-Amino-4-chlorophenylboronic acid, pinacol ester. It belongs to the product categories of Blocks; Boronic Acids. This chemical's molecular formula is C₁₂H₁₇BClNO₂ and molecular weight is 253.53. What's more, its systematic name is 2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline.

Physical properties of Benzenamine,2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)- are: (1)#H bond acceptors: 3; (2)#H bond donors: 2; (3)#Freely Rotating Bonds: 2; (4)Polar Surface Area: 44.48 Å²; (5)Index of Refraction: 1.53; (6)Molar Refractivity: 67.9 cm³; (7)Molar Volume: 219.5 cm³; (8)Polarizability: 26.91×10^-24cm³; (9)Surface Tension: 38.5 dyne/cm; (10)Density: 1.15 g/cm³; (11)Flash Point: 172.4 °C; (12)Enthalpy of Vaporization: 60.73 kJ/mol; (13)Boiling Point: 361.5 °C at 760 mmHg; (14)Vapour Pressure: 2.06E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: B1(OC(C(O1)(C)C)(C)C)c2ccc(c(c2)N)Cl
(2)InChI: InChI=1S/C12H17BClNO2/c1-11(2)12(3,4)17-13(16-11)8-5-6-9(14)10(15)7-8/h5-7H,15H2,1-4H3
(3)InChIKey: KHGJUVPQSMKNFA-UHFFFAOYSA-N

Product Name

3-AMINO-4-CHLOROPHENYLBORONIC ACID, PINACOL ESTER

Benzenamine,2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)- Specification

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