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155394-02-8 | 3-Octanol, 2-[(R)-(4-methylphenyl)sulfinyl]-1-(trimethylsilyl)-, (2R,3R)-
CAS No: 155394-02-8 Catalog No: AG001NUU MDL No:
Product Description
Catalog Number:
AG001NUU
Chemical Name:
3-Octanol, 2-[(R)-(4-methylphenyl)sulfinyl]-1-(trimethylsilyl)-, (2R,3R)-
CAS Number:
155394-02-8
Molecular Formula:
C18H32O2SSi
Molecular Weight:
340.5960
IUPAC Name:
(2R,3R)-2-[(R)-(4-methylphenyl)sulfinyl]-1-trimethylsilyloctan-3-ol
InChI:
InChI=1S/C18H32O2SSi/c1-6-7-8-9-17(19)18(14-22(3,4)5)21(20)16-12-10-15(2)11-13-16/h10-13,17-19H,6-9,14H2,1-5H3/t17-,18+,21+/m1/s1
InChI Key:
PGUIQSUKMNFCSQ-LQWHRVPQSA-N
SMILES:
CCCCC[C@H]([C@@H]([S@@](=O)c1ccc(cc1)C)C[Si](C)(C)C)O
Properties
Complexity:
333
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
340.189g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
340.597g/mol
Monoisotopic Mass:
340.189g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
56.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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