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139109-02-7 | 4-Hexenal, 6-[[(1,1-dimethylethyl)diphenylsilyl]oxy]-4-methyl-, (4E)-
CAS No: 139109-02-7 Catalog No: AG001AAL MDL No:
Product Description
Catalog Number:
AG001AAL
Chemical Name:
4-Hexenal, 6-[[(1,1-dimethylethyl)diphenylsilyl]oxy]-4-methyl-, (4E)-
CAS Number:
139109-02-7
Molecular Formula:
C23H30O2Si
Molecular Weight:
366.5686
IUPAC Name:
6-[tert-butyl(diphenyl)silyl]oxy-4-methylhex-4-enal
InChI:
InChI=1S/C23H30O2Si/c1-20(12-11-18-24)17-19-25-26(23(2,3)4,21-13-7-5-8-14-21)22-15-9-6-10-16-22/h5-10,13-18H,11-12,19H2,1-4H3
InChI Key:
XCBHPKRJUDPUNA-UHFFFAOYSA-N
SMILES:
O=CCC/C(=C/CO[Si](C(C)(C)C)(c1ccccc1)c1ccccc1)/C
Properties
Complexity:
433
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
366.202g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
366.576g/mol
Monoisotopic Mass:
366.202g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
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