CAS No.17250-25-8,HYDRIDOCARBONYLTRIS(TRIPHENYLPHOSPHINE)IRIDIUM (I) Suppliers

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Basic Information

Molecular Structure:
CAS No.:	17250-25-8
Name:	HYDRIDOCARBONYLTRIS(TRIPHENYLPHOSPHINE)IRIDIUM (I)

Formula:	C₅₅H₄₅IrOP₃
Molecular Weight:	1008.11
Synonyms:	Iridium,hydrocarbonyltris(triphenylphosphine)- (7CI);Carbonylhydridotris(triphenylphosphine)iridium;Carbonylhydrotris(triphenylphosphine)iridium;Hydrocarbonyltris(triphenylphosphine)iridium;
EINECS:	241-282-7
Melting Point:	170°C (dec.)
Boiling Point:	360 °C at 760 mmHg
Flash Point:	181.7 °C
Appearance:	pale yellow powder
Hazard Symbols:	Xn
Risk Codes:	36/37/38
Safety:	26-36/37/39
Transport Information:	UN2813
PSA:	40.77000
LogP:	10.12640

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Specification

The Iridium,carbonylhydrotris(triphenylphosphine)-, with CAS registry number 17250-25-8, has the systematic name of carbon monoxide; iridium; triphenylphosphane. This chemical is a kind of pale yellow powder. And the chemical formula of this chemical is C₅₅H₄₅IrOP₃. What's more, its EINECS is 241-282-7.

Physical properties of Iridium,carbonylhydrotris(triphenylphosphine)-: (1)ACD/LogP: 5.69; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6; (4)ACD/LogD (pH 7.4): 6; (5)ACD/BCF (pH 5.5): 12428; (6)ACD/BCF (pH 7.4): 12428; (7)ACD/KOC (pH 5.5): 29673; (8)ACD/KOC (pH 7.4): 29673; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 13.59 Å²; (13)Flash Point: 181.7 °C; (14)Enthalpy of Vaporization: 58.18 kJ/mol; (15)Boiling Point: 360 °C at 760 mmHg; (16)Vapour Pressure: 4.74E-05 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The Iridium,carbonylhydrotris(triphenylphosphine)- irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: [C-]#[O+].c1ccc(cc1)P(c2ccccc2)c3ccccc3.c1ccc(cc1)P(c2ccccc2)c3ccccc3.c1ccc(cc1)P(c2ccccc2)c3ccccc3.[Ir]
(2)InChI: InChI=1/3C18H15P.CO.Ir/c3*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2;/h3*1-15H
(3)InChIKey: OWVGPTPQWABNND-UHFFFAOYAZ
(4)Std. InChI: InChI=1S/3C18H15P.CO.Ir/c3*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2;/h3*1-15H
(5)Std. InChIKey: OWVGPTPQWABNND-UHFFFAOYSA-N