CAS No.156837-90-0,P-(4-PROPYLCYCLOHEXYL)PHENYLBORONIC ACID Suppliers

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Basic Information

Molecular Structure:
CAS No.:	156837-90-0
Name:	P-(4-PROPYLCYCLOHEXYL)PHENYLBORONIC ACID

Formula:	C₁₅H₂₃BO₂
Molecular Weight:	246.157
Synonyms:	[4-(4-Propylcyclohexyl)phenyl]boric acid;Boronicacid, [4-(4-propylcyclohexyl)phenyl]- (9CI);
Density:	1.03 g/cm³
Boiling Point:	394.9 °C at 760 mmHg
Flash Point:	192.7 °C
PSA:	40.46000
LogP:	2.44030

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Specification

The Boronic acid,B-[4-(4-propylcyclohexyl)phenyl]-, with the CAS registry number 156837-90-0, is also known as p-(4-Propylcyclohexyl)thenylboronic acid. This chemical's molecular formula is C₁₅H₂₃BO₂ and molecular weight is 246.1529. What's more, both its IUPAC name and systematic name are the same which is called [4-(4-Propylcyclohexyl)phenyl]boronic acid.

Physical properties about Boronic acid,B-[4-(4-propylcyclohexyl)phenyl]- are: (1)ACD/LogP: 5.66; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.66; (4)ACD/LogD (pH 7.4): 5.64; (5)ACD/BCF (pH 5.5): 11861.7; (6)ACD/BCF (pH 7.4): 11302.34; (7)ACD/KOC (pH 5.5): 28693.61; (8)ACD/KOC (pH 7.4): 27340.51; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 18.46 Å²; (13)Index of Refraction: 1.527; (14)Molar Refractivity: 72.87 cm³; (15)Molar Volume: 236.7 cm³; (16)Polarizability: 28.88×10^-24cm³; (17)Surface Tension: 40.4 dyne/cm; (18)Density: 1.03 g/cm³; (19)Flash Point: 192.7 °C; (20)Enthalpy of Vaporization: 68.03 kJ/mol; (21)Boiling Point: 394.9 °C at 760 mmHg; (22)Vapour Pressure: 6.03E-07 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: OB(O)c1ccc(cc1)C2CCC(CCC)CC2
(2) InChI: InChI=1/C15H23BO2/c1-2-3-12-4-6-13(7-5-12)14-8-10-15(11-9-14)16(17)18/h8-13,17-18H,2-7H2,1H3
(3) InChIKey: QTBUVZSHCNAPRT-UHFFFAOYAA