Benzenamine,2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, hydrochloride (1:1) supplier

Name
3-AMINO-4-METHYLPHENYLBORONIC ACID, PINACOL ESTER, HCL
EINECS
CAS No. 850567-52-1
Density
Solubility
Melting Point 234-238 °C
Formula C₁₃H₂₁BClNO₂
Boiling Point 390.3 °C at 760 mmHg
Molecular Weight 269.58
Flash Point 189.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms Benzenamine,2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, hydrochloride (9CI);2-Methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline hydrochloride;3-Amino-4-methylphenylboronic acid, pinacol ester, HCl;
PSA 44.48000
LogP 3.25960

Benzenamine,2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, hydrochloride (1:1) Specification

The Benzenamine,2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, hydrochloride (1:1), with the CAS registry number 850567-52-1, is also known as 3-Amino-4-methylphenylboronic acid, pinacol ester, HCl. It belongs to the product categories of Blocks; Boronic Acids. This chemical's molecular formula is C₁₃H₂₁BClNO₂ and molecular weight is 269.58. What's more, its systematic name is 2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline hydrochloride.

Physical properties of Benzenamine,2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, hydrochloride (1:1) are: (1)#H bond acceptors: 3; (2)#H bond donors: 2; (3)#Freely Rotating Bonds: 2; (4)Polar Surface Area: 44.48 Å²; (5)Flash Point: 189.8 °C; (6)Enthalpy of Vaporization: 65.22 kJ/mol; (7)Boiling Point: 390.3 °C at 760 mmHg; (8)Vapour Pressure: 1.79E-06 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)C.Cl
(2)InChI: InChI=1S/C13H20BNO2.ClH/c1-9-6-7-10(8-11(9)15)14-16-12(2,3)13(4,5)17-14;/h6-8H,15H2,1-5H3;1H
(3)InChIKey: YZVBFDWPOULPGM-UHFFFAOYSA-N

Product Name

3-AMINO-4-METHYLPHENYLBORONIC ACID, PINACOL ESTER, HCL

Benzenamine,2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, hydrochloride (1:1) Specification

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