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Phosphine,tris(2,5-dimethylphenyl)- (115034-38-3)

Identification
Name:Phosphine,tris(2,5-dimethylphenyl)-
Synonyms:Tri(2,5-dimethylphenyl)phosphine;Phosphine,tri-2,5-xylyl- (6CI);Tri-2,5-xylylphosphine;Tri-p-xylylphosphine;Tris(2,5-dimethylphenyl)phosphine;Tris(2,5-xylyl)phosphine;Tris(2,5-dimethylphenyl)phosphine;Tris(p-xylyl)phosphine;
CAS:115034-38-3
Molecular Formula: C24H27P
Molecular Weight: 346.44
InChI: InChI=1/C24H27P/c1-16-7-10-19(4)22(13-16)25(23-14-17(2)8-11-20(23)5)24-15-18(3)9-12-21(24)6/h7-15H,1-6H3
Molecular Structure: (C24H27P) Tri(2,5-dimethylphenyl)phosphine;Phosphine,tri-2,5-xylyl- (6CI);Tri-2,5-xylylphosphine;Tri-p-xylylph...
Properties
Melting Point: 154-158 °C
Appearance:liquid
Specification:

The Tris(2,5-dimethylphenyl)phosphine with the CAS number 115034-38-3 is also called Phosphine,tris(2,5-dimethylphenyl)-. Its molecular formula is C24H27P. This chemical is white powder. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the chemical are: (1)ACD/LogP: 8.45; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 8.45; (4)ACD/LogD (pH 7.4): 8.45; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 942001.25; (8)ACD/KOC (pH 7.4): 942001.25; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 13.59 Å2; (13)Enthalpy of Vaporization: 70.12 kJ/mol; (14)Vapour Pressure: 1.86×10-8 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: c3(c(P(c1cc(ccc1C)C)c2cc(ccc2C)C)cc(cc3)C)C
(2)InChI: InChI=1/C24H27P/c1-16-7-10-19(4)22(13-16)25(23-14-17(2)8-11-20(23)5)24-15-18(3)9-12-21(24)6/h7-15H,1-6H3
(3)InChIKey: KAAYGTMPJQOOGY-UHFFFAOYAQ

Safety Data
Hazard Symbols Xn: Harmful
 

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