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100991-27-3 | 9-Dodecyn-2-ol, 12-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-
CAS No: 100991-27-3 Catalog No: AG0003E1 MDL No:
Product Description
Catalog Number:
AG0003E1
Chemical Name:
9-Dodecyn-2-ol, 12-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-
CAS Number:
100991-27-3
Molecular Formula:
C18H36O2Si
Molecular Weight:
312.5627
IUPAC Name:
12-[tert-butyl(dimethyl)silyl]oxydodec-9-yn-2-ol
InChI:
InChI=1S/C18H36O2Si/c1-17(19)15-13-11-9-7-8-10-12-14-16-20-21(5,6)18(2,3)4/h17,19H,7-9,11,13-16H2,1-6H3
InChI Key:
BCTXTEIFSIJAFR-UHFFFAOYSA-N
SMILES:
CC(CCCCCCC#CCCO[Si](C(C)(C)C)(C)C)O
Properties
Complexity:
330
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
312.248g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
312.569g/mol
Monoisotopic Mass:
312.248g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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