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4-(2-Naphthyl)phenylboronic acid

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Name

4-(2-Naphthyl)phenylboronic acid

EINECS 805-884-9
CAS No. 918655-03-5 Density 1.23 g/cm3
PSA 40.46000 LogP 2.18660
Solubility N/A Melting Point N/A
Formula C16H13BO2 Boiling Point 463 °C at 760 mmHg
Molecular Weight 248.089 Flash Point 233.8 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 918655-03-5 (4-(NAPHTHALEN-2-YL)PHENYLBORONIC ACID) Hazard Symbols N/A
Synonyms

4-(NAPHTHALEN-2-YL)PHENYLBORONIC ACID ;4-(2-Naphthyl)benzeneboronic acid, 97%;4-(naphthalen-2-yl)phenylboronic;4-(2-Napthyl)phenylboronic acid;4-(2-Naphthyl)phenylboronic Acid (contains varying aMounts of Anhydride);4-(2-naphthyl)phenylboronic acid (2NPBA);4-(2-phthyl)phenylboronic acid;4-(2-Naphthyl)phenylboronic

Article Data 9

4-(2-Naphthyl)phenylboronic acid Specification

The Boronicacid, B-[4-(2-naphthalenyl)phenyl]-, with the cas registry number 918655-03-5, has its IUPAC name of (4-naphthalen-2-ylphenyl)boronic acid. And its systematic name is [4-(2-naphthyl)phenyl]boronic acid.

The characteristics of this chemical are as below: (1)ACD/LogP: 4.58; (2)ACD/LogD (pH 5.5): 4.58; (3)ACD/LogD (pH 7.4): 4.55; (4)#H bond acceptors: 2; (5)#H bond donors: 2; (6)#Freely Rotating Bonds: 4; (7)Polar Surface Area: 40.46; (8)Index of Refraction: 1.676; (9)Molar Refractivity: 75.55 cm3; (10)Molar Volume: 200.7 cm3; (11)Polarizability: 29.95 ×10-24 cm3; (12)Surface Tension: 55.8 dyne/cm; (13)Density: 1.23 g/cm3; (14)Flash Point: 233.8 °C; (15)Enthalpy of Vaporization: 76.3 kJ/mol; (16)Boiling Point: 463 °C at 760 mmHg; (17)Vapour Pressure: 2.27E-09 mmHg at 25°C; (18)Exact Mass: 248.10086; (19)MonoIsotopic Mass: 248.10086; (20)Topological Polar Surface Area: 40.5; (21)Heavy Atom Count: 19; (22)Formal Charge: 0; (23)Complexity: 287.

Additionally, you could convert the following datas into the molecular structure:
(1)Canonical SMILES: B(C1=CC=C(C=C1)C2=CC3=CC=CC=C3C=C2)(O)O
(2)InChI: InChI=1S/C16H13BO2/c18-17(19)16-9-7-13(8-10-16)15-6-5-12-3-1-2-4-14(12)11-15/h1-11,18-19H 
(3)InChIKey: ICQAKBYFBIWELX-UHFFFAOYSA-N 

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