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100693-33-2 | Benzene, [[1-cyclohexen-1-yl(trimethylsilyl)methyl]thio]-
CAS No: 100693-33-2 Catalog No: AG0002MU MDL No:
Product Description
Catalog Number:
AG0002MU
Chemical Name:
Benzene, [[1-cyclohexen-1-yl(trimethylsilyl)methyl]thio]-
CAS Number:
100693-33-2
Molecular Formula:
C16H24SSi
Molecular Weight:
276.5123
IUPAC Name:
[cyclohexen-1-yl(phenylsulfanyl)methyl]-trimethylsilane
InChI:
InChI=1S/C16H24SSi/c1-18(2,3)16(14-10-6-4-7-11-14)17-15-12-8-5-9-13-15/h5,8-10,12-13,16H,4,6-7,11H2,1-3H3
InChI Key:
QLMZMIGSSKFJMP-UHFFFAOYSA-N
SMILES:
C[Si](C(C1=CCCCC1)Sc1ccccc1)(C)C
Properties
Complexity:
284
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.137g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.513g/mol
Monoisotopic Mass:
276.137g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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