CAS No.3053-68-7,Triphenylborane-triphenylphosphine complex Suppliers

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Basic Information

Molecular Structure:
CAS No.:	3053-68-7
Name:	Triphenylborane-triphenylphosphine complex

Formula:	C₃₆H₃₀BP
Molecular Weight:	504.41
Synonyms:	Borane,triphenyl-, compd. with triphenylphosphine (1:1) (7CI);Phosphine, triphenyl-,compd. with triphenylborane (1:1) (8CI);TPP-S;TPP-S (initiator);Triphenyl(triphenylphosphine)borane;Triphenylphosphine-triphenylborane;
Melting Point:	195～210℃
Boiling Point:	348 °C at 760 mmHg
Flash Point:	161.1 °C
Solubility:	Insoluble in water
PSA:	13.59000
LogP:	5.64760

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Specification

The Boron,triphenyl(triphenylphosphine)-, (T-4)-, with the CAS registry number 3053-68-7, is also known as Triphenylborane - Triphenylphosphine Complex. It belongs to the product categories of B (Classes of Boron Compounds); Boranes. This chemical's molecular formula is C₃₆H₃₀BP and molecular weight is 504.4082. Its systematic name is called triphenylborane - triphenylphosphane (1:1).

Physical properties of Boron,triphenyl(triphenylphosphine)-, (T-4)-: (1)ACD/LogP: 5.35; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5; (4)ACD/LogD (pH 7.4): 5; (5)ACD/BCF (pH 5.5): 6880; (6)ACD/BCF (pH 7.4): 6880; (7)ACD/KOC (pH 5.5): 19434; (8)ACD/KOC (pH 7.4): 19434; (9)#Freely Rotating Bonds: 3; (10)Flash Point: 161.1 °C; (11)Enthalpy of Vaporization: 56.89 kJ/mol; (12)Boiling Point: 348 °C at 760 mmHg; (13)Vapour Pressure: 0.000104 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: c3c(P(c1ccccc1)c2ccccc2)cccc3.c1ccccc1B(c2ccccc2)c3ccccc3
(2)InChI: InChI=1/C18H15B.C18H15P/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18/h2*1-15H
(3)InChIKey: QLAGHGSFXJZWKY-UHFFFAOYAF