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178358-58-2

178358-58-2 | Phosphorous trichloride, reaction products with 1,1'-biphenyl and 2,4-bis(1,1-dimethylethyl)-5-methylphenol

CAS No: 178358-58-2 Catalog No: AG0025YW MDL No:

Product Description

Catalog Number:
AG0025YW
Chemical Name:
Phosphorous trichloride, reaction products with 1,1'-biphenyl and 2,4-bis(1,1-dimethylethyl)-5-methylphenol
CAS Number:
178358-58-2
Molecular Formula:
C72H100O4P2
Molecular Weight:
1091.5095
IUPAC Name:
[2-bis(2,4-ditert-butyl-5-methylphenoxy)phosphanyl-3-phenylphenyl]-bis(2,4-ditert-butyl-5-methylphenoxy)phosphane
InChI:
InChI=1S/C72H100O4P2/c1-45-37-59(55(69(17,18)19)41-51(45)65(5,6)7)73-77(74-60-38-46(2)52(66(8,9)10)42-56(60)70(20,21)22)63-36-32-35-50(49-33-30-29-31-34-49)64(63)78(75-61-39-47(3)53(67(11,12)13)43-57(61)71(23,24)25)76-62-40-48(4)54(68(14,15)16)44-58(62)72(26,27)28/h29-44H,1-28H3
InChI Key:
XMKVUPOWKZQBDQ-UHFFFAOYSA-N
SMILES:
Cc1cc(OP(c2cccc(c2P(Oc2cc(C)c(cc2C(C)(C)C)C(C)(C)C)Oc2cc(C)c(cc2C(C)(C)C)C(C)(C)C)c2ccccc2)Oc2cc(C)c(cc2C(C)(C)C)C(C)(C)C)c(cc1C(C)(C)C)C(C)(C)C

Properties

Complexity:
1740  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
1090.71g/mol
Formal Charge:
0
Heavy Atom Count:
78  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
1091.536g/mol
Monoisotopic Mass:
1090.71g/mol
Rotatable Bond Count:
19  
Topological Polar Surface Area:
36.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
25  

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