4-(1-Naphthyl)phenylboronic acid supplier

Name
4-(NAPHTHALEN-1-YL)PHENYLBORONIC ACID
EINECS 678-309-0
CAS No. 870774-25-7
Article Data3
CAS DataBase
Density 1.23 g/cm³
Solubility
Melting Point
Formula C₁₆H₁₃ B O₂
Boiling Point 449.4 °C at 760 mmHg
Molecular Weight 248.089
Flash Point 225.6 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Boronicacid, [4-(1-naphthalenyl)phenyl]- (9CI);4-(naphthalen-1-yl)phenylboronic acid;
PSA 40.46000
LogP 2.18660

4-(1-Naphthyl)phenylboronic acid Specification

The 4-(1-Naphthyl)phenylboronic acid, with the cas registry number 870774-25-7, has the systematic name of [4-(1-naphthyl)phenyl]boronic acid. And this chemical is usually used as common the chemical reagent and its product categories are including B (Classes of Boron Compounds); Boronic Acids.

The characteristics of this chemical are as below: (1)ACD/LogP: 4.58; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.58; (4)ACD/LogD (pH 7.4): 4.55; (5)#H bond acceptors: 2; (6)#H bond donors: 2; (7)#Freely Rotating Bonds: 4; (8)Polar Surface Area: 40.46; (9)Index of Refraction: 1.676; (10)Molar Refractivity: 75.55 cm³; (11)Molar Volume: 200.7 cm³; (12)Polarizability: 29.95× 10^-24 cm³; (13)Surface Tension: 55.8 dyne/cm; (14)Density: 1.23 g/cm³; (15)Flash Point: 225.6 °C; (16)Enthalpy of Vaporization: 74.62 kJ/mol; (17)Boiling Point: 449.4 °C at 760 mmHg; (18)Vapour Pressure: 7.33E-09 mmHg at 25°C; (19)Exact Mass: 248.10086; (20)MonoIsotopic Mass: 248.10086; (21)Topological Polar Surface Area: 40.5; (22)Heavy Atom Count: 19; (23)Formal Charge: 0; (24)Complexity: 287.

Additionally, you could convert the following datas into the molecular structure:
(1)SMILES:OB(O)c1ccc(cc1)c2cccc3ccccc23
(2)InChI:InChI=1/C16H13BO2/c18-17(19)14-10-8-13(9-11-14)16-7-3-5-12-4-1-2-6-15(12)16/h1-11,18-19H
(3)InChIKey:BQHVXFQXTOIMQM-UHFFFAOYAQ

Product Name

4-(NAPHTHALEN-1-YL)PHENYLBORONIC ACID

4-(1-Naphthyl)phenylboronic acid Specification

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