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2-Dicyclohexylphosphino-2',6'-diisopropoxy-1,1'-biphenyl

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Name

2-Dicyclohexylphosphino-2',6'-diisopropoxy-1,1'-biphenyl

EINECS 616-653-5
CAS No. 787618-22-8 Density N/A
PSA 32.05000 LogP 8.70060
Solubility N/A Melting Point 123-124 °C
Formula C30H43O2P Boiling Point 551.7 °C at 760 mmHg
Molecular Weight 466.644 Flash Point 360.7 °C
Transport Information N/A Appearance N/A
Safety 26-36/37/39 Risk Codes 36/37/38-20/21/22
Molecular Structure Molecular Structure of 787618-22-8 (2-DICYCLOHEXYLPHOSPHINO-2',6'-DI-I-PROPOXY-1,1'-BIPHENYL) Hazard Symbols HarmfulXn
Synonyms

2-(Dicyclohexylphosphino)-2',6'-isopropoxybiphenyl;

Article Data 2

2-Dicyclohexylphosphino-2',6'-diisopropoxy-1,1'-biphenyl Specification

The Phosphine,[2',6'-bis(1-methylethoxy)[1,1'-biphenyl]-2-yl]dicyclohexyl-, with the CAS registry number 787618-22-8, is also known as Dicyclohexyl(2',6'-diisopropoxybiphenyl-2-yl)phosphine. This chemical's molecular formula is C30H43O2P and molecular weight is 466.63. What's more, its systematic name is called [2',6'-Bis(1-methylethoxy)biphenyl-2-yl](dicyclohexyl)phosphane.

Physical properties about Phosphine,[2',6'-bis(1-methylethoxy)[1,1'-biphenyl]-2-yl]dicyclohexyl- are: (1)ACD/LogP: 9.42; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 9.42; (4)ACD/LogD (pH 7.4): 9.42; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 3153523; (8)ACD/KOC (pH 7.4): 3153523; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 32.05 Å2; (13)Flash Point: 360.7 °C; (14)Enthalpy of Vaporization: 80.1 kJ/mol; (15)Boiling Point: 551.7 °C at 760 mmHg; (16)Vapour Pressure: 1.18E-11 mmHg at 25 °C.

When you are dealing with this chemical, you should be very careful. This chemical is irritating to eyes, respiratory system and skin. It is harmful by inhalation, in contact with skin and if swallowed. What's more, this chemical may cause damage to health. Therefore, you should wear suitable protective clothing, gloves and eye/face protection. In case of contacting with eyes, you should rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1) SMILES: O(c1cccc(OC(C)C)c1c4ccccc4P(C2CCCCC2)C3CCCCC3)C(C)C
(2) InChI: InChI=1/C30H43O2P/c1-22(2)31-27-19-13-20-28(32-23(3)4)30(27)26-18-11-12-21-29(26)33(24-14-7-5-8-15-24)25-16-9-6-10-17-25/h11-13,18-25H,5-10,14-17H2,1-4H3
(3) InChIKey: MXFYYFVVIIWKFE-UHFFFAOYAL

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