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189561-71-5 | Phenol, 2,6-bis[[bis(1,1-dimethylethyl)phosphino]methyl]-4-methyl-
CAS No: 189561-71-5 Catalog No: AG002DQN MDL No:
Product Description
Catalog Number:
AG002DQN
Chemical Name:
Phenol, 2,6-bis[[bis(1,1-dimethylethyl)phosphino]methyl]-4-methyl-
CAS Number:
189561-71-5
Molecular Formula:
C25H46OP2
Molecular Weight:
424.5797
IUPAC Name:
2,6-bis(ditert-butylphosphanylmethyl)-4-methylphenol
InChI:
InChI=1S/C25H46OP2/c1-18-14-19(16-27(22(2,3)4)23(5,6)7)21(26)20(15-18)17-28(24(8,9)10)25(11,12)13/h14-15,26H,16-17H2,1-13H3
InChI Key:
GDKGOMGLLKXLCV-UHFFFAOYSA-N
SMILES:
Cc1cc(CP(C(C)(C)C)C(C)(C)C)c(c(c1)CP(C(C)(C)C)C(C)(C)C)O
Properties
Complexity:
415
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
424.302g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
424.59g/mol
Monoisotopic Mass:
424.302g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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