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1010086-31-3 | Cyclohexanecarboxylic acid, 4-[[(1,1-dimethylethyl)diphenylsilyl]oxy]-, 1,1-dimethylethyl ester
CAS No: 1010086-31-3 Catalog No: AG0003HR MDL No:MFCD17392810
Product Description
Catalog Number:
AG0003HR
Chemical Name:
Cyclohexanecarboxylic acid, 4-[[(1,1-dimethylethyl)diphenylsilyl]oxy]-, 1,1-dimethylethyl ester
CAS Number:
1010086-31-3
Molecular Formula:
C27H38O3Si
Molecular Weight:
438.6743
MDL Number:
MFCD17392810
IUPAC Name:
tert-butyl 4-[tert-butyl(diphenyl)silyl]oxycyclohexane-1-carboxylate
InChI:
InChI=1S/C27H38O3Si/c1-26(2,3)29-25(28)21-17-19-22(20-18-21)30-31(27(4,5)6,23-13-9-7-10-14-23)24-15-11-8-12-16-24/h7-16,21-22H,17-20H2,1-6H3
InChI Key:
GNDRGHSKWPDYSS-UHFFFAOYSA-N
SMILES:
O=C(C1CCC(CC1)O[Si](C(C)(C)C)(c1ccccc1)c1ccccc1)OC(C)(C)C
Properties
Complexity:
550
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
438.259g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
438.683g/mol
Monoisotopic Mass:
438.259g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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