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113893-24-6 | Cyclohexanone, 3-[4-(trimethylsilyl)-3-butyn-1-yl]-
CAS No: 113893-24-6 Catalog No: AG000A07 MDL No:
Product Description
Catalog Number:
AG000A07
Chemical Name:
Cyclohexanone, 3-[4-(trimethylsilyl)-3-butyn-1-yl]-
CAS Number:
113893-24-6
Molecular Formula:
C13H22OSi
Molecular Weight:
222.3987
IUPAC Name:
3-(4-trimethylsilylbut-3-ynyl)cyclohexan-1-one
InChI:
InChI=1S/C13H22OSi/c1-15(2,3)10-5-4-7-12-8-6-9-13(14)11-12/h12H,4,6-9,11H2,1-3H3
InChI Key:
KRQZTPPRGNHKJV-UHFFFAOYSA-N
SMILES:
O=C1CCCC(C1)CCC#C[Si](C)(C)C
Properties
Complexity:
287
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.144g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.403g/mol
Monoisotopic Mass:
222.144g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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