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182250-68-6 | Benzoic acid, 3,5-bis[[(1,1-dimethylethyl)diphenylsilyl]oxy]-, methyl ester
CAS No: 182250-68-6 Catalog No: AG0023ID MDL No:
Product Description
Catalog Number:
AG0023ID
Chemical Name:
Benzoic acid, 3,5-bis[[(1,1-dimethylethyl)diphenylsilyl]oxy]-, methyl ester
CAS Number:
182250-68-6
Molecular Formula:
C40H44O4Si2
Molecular Weight:
644.9460
IUPAC Name:
methyl 3,5-bis[[tert-butyl(diphenyl)silyl]oxy]benzoate
InChI:
InChI=1S/C40H44O4Si2/c1-39(2,3)45(34-20-12-8-13-21-34,35-22-14-9-15-23-35)43-32-28-31(38(41)42-7)29-33(30-32)44-46(40(4,5)6,36-24-16-10-17-25-36)37-26-18-11-19-27-37/h8-30H,1-7H3
InChI Key:
DGYIOKNASZQETF-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(cc(c1)O[Si](C(C)(C)C)(c1ccccc1)c1ccccc1)O[Si](C(C)(C)C)(c1ccccc1)c1ccccc1
Properties
Complexity:
841
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
644.278g/mol
Formal Charge:
0
Heavy Atom Count:
46
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
644.958g/mol
Monoisotopic Mass:
644.278g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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