Boronic acid,B-[4-(1-pyrrolidinyl)phenyl]- supplier

Name
(4-PYRROLIDIN-1-YLPHENYL)BORONIC ACID
EINECS
CAS No. 229009-41-0
Density 1.19 g/cm³
Solubility
Melting Point
Formula C₁₀H₁₄BNO₂
Boiling Point 403.2 °C at 760 mmHg
Molecular Weight 191.038
Flash Point 197.7 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Pyrrolidinophenylboronic acid;[4-(Pyrrolidin-1-yl)phenyl]boronic acid;
PSA 43.70000
LogP 0.03160

Boronic acid,B-[4-(1-pyrrolidinyl)phenyl]- Specification

The Boronic acid,B-[4-(1-pyrrolidinyl)phenyl]-, with the CAS registry number 229009-41-0, is also known as [4-(Pyrrolidin-1-yl)phenyl]boronic acid. It belongs to the product categories of API intermediates; Boronic Acid. This chemical's molecular formula is C₁₀H₁₄BNO₂ and molecular weight is 191.03. Its systematic name is called (3-pyrrolidin-1-ylphenyl)boronic acid.

Physical properties of Boronic acid,B-[4-(1-pyrrolidinyl)phenyl]-: (1)ACD/LogP: 1.79; (2)ACD/LogD (pH 5.5): 1.68; (3)ACD/LogD (pH 7.4): 1.72; (4)ACD/BCF (pH 5.5): 10.45; (5)ACD/BCF (pH 7.4): 11.46; (6)ACD/KOC (pH 5.5): 173.93; (7)ACD/KOC (pH 7.4): 190.6; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 4; (11)Index of Refraction: 1.583; (12)Molar Refractivity: 53.64 cm³; (13)Molar Volume: 160.3 cm³; (14)Surface Tension: 50.2 dyne/cm; (15)Density: 1.19 g/cm³; (16)Flash Point: 197.7 °C; (17)Enthalpy of Vaporization: 69.02 kJ/mol; (18)Boiling Point: 403.2 °C at 760 mmHg; (19)Vapour Pressure: 3.17E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: OB(O)c1cccc(c1)N2CCCC2
(2)InChI: InChI=1/C10H14BNO2/c13-11(14)9-4-3-5-10(8-9)12-6-1-2-7-12/h3-5,8,13-14H,1-2,6-7H2
(3)InChIKey: OADUVPSZJLNMCG-UHFFFAOYAS

Product Name

(4-PYRROLIDIN-1-YLPHENYL)BORONIC ACID

Boronic acid,B-[4-(1-pyrrolidinyl)phenyl]- Specification

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