2,6-Bis[4-(trifluoromethyl)phenyl]-8,9,10,11,12,13,14,15-octahydrodinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepin-4-ol 4-oxide | CAS No. 791616-70-1

2,6-Bis[4-(trifluoromethyl)phenyl]-8,9,10,11,12,13,14,15-octahydrodinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepin-4-ol 4-oxide

Basic Information

CAS Number

791616-70-1

Molecular Formula

C34H27F6O4P

Molecular Weight

644.55 g/mol

AD

Basic Physical Properties

OP1(=O)Oc2c(cc3c(c2c2c(O1)c(cc1c2CCCC1)c1ccc(cc1)C(F)(F)F)CCCC3)c1ccc(cc1)C(F)(F)F

InChI

InChI=1S/C34H27F6O4P/c35-33(36,37)23-13-9-19(10-14-23)27-17-21-5-1-3-7-25(21)29-30-26-8-4-2-6-22(26)18-28(32(30)44-45(41,42)43-31(27)29)20-11-15-24(16-12-20)34(38,39)40/h9-18H,1-8H2,(H,41,42)

InChIKey

XURGUTVGAFTYCS-UHFFFAOYSA-N

LogP

10.354399999999993

Topological Polar Surface Area

55.760000000000005 Ų

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

1000

Synonyms & References

English

  • (11bR)​-8,​9,​10,​11,​12,​13,​14,​15-Octahydro-​4-​hydroxy-​2,​6-​bis[4-​(trifluoromethyl)​phenyl]​-4-​oxide-dinaphtho[2,​1-​d:1',​2'-​f]​[1,​3,​2]​dioxaphosphepin
  • (11bR)?-8,?9,?10,?11,?12,?13,?14,?15-Octahydro-?4-?hydroxy-?2,?6-?bis[4-?(trifluoromethyl)?phenyl]?-4-?oxide-dinaphtho[2,?1-?d:1',?2'-?f]?[1,?3,?2]?dioxaphosphepin
  • E74919
  • E75140
  • (11BS)-4-hydroxy-2,6-bis(4-(trifluoromethyl)phenyl)-8,9,10,11,12,13,14,15-octahydrodinaphtho[2,1-d:1

MDL Number

MFCD31747029

FAQ

What are the physical and chemical properties of 2,6-Bis[4-(trifluoromethyl)phenyl]-8,9,10,11,12,13,14,15-octahydrodinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepin-4-ol 4-oxide (CAS: 791616-70-1)?

This compound is a crystalline solid with a high molecular weight. It has limited solubility in common organic solvents but is slightly soluble in water. It is generally stable under normal conditions but may react with strong acids or bases. It has a high reactivity due to the presence of the phosphorus atom and the trifluoromethyl substituents.

How is 2,6-Bis[4-(trifluoromethyl)phenyl]-8,9,10,11,12,13,14,15-octahydrodinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepin-4-ol 4-oxide (CAS: 791616-70-1) typically synthesized?

This compound is typically synthesized through multi-step organic reactions, involving protection and deprotection of functional groups, and coupling reactions. The synthesis often requires the use of catalysts and specialty reagents. The specific conditions, such as temperature and pressure, must be carefully controlled to achieve the desired yield and selectivity.

What industries use 2,6-Bis[4-(trifluoromethyl)phenyl]-8,9,10,11,12,13,14,15-octahydrodinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepin-4-ol 4-oxide (CAS: 791616-70-1)?

This compound is primarily used in the pharmaceutical industry for its potential as a drug candidate. It may also find applications in the polymer industry for its unique chemical properties, and in the sensor and semiconductor industries due to its electronic characteristics.

What precautions should be taken when handling 2,6-Bis[4-(trifluoromethyl)phenyl]-8,9,10,11,12,13,14,15-octahydrodinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepin-4-ol 4-oxide (CAS: 791616-70-1)?

Proper personal protective equipment (PPE) should be worn, including gloves, goggles, and a lab coat. This compound should be handled in a well-ventilated area or a fume hood. Spills should be cleaned up using appropriate absorbent materials and disposed of according to local regulations. Always refer to the Safety Data Sheet (SDS) for specific handling instructions and emergency procedures.

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