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116996-52-2 | 1,2-Butanediol, 4-[[(1,1-dimethylethyl)diphenylsilyl]oxy]-, (2S)-
CAS No: 116996-52-2 Catalog No: AG000DGX MDL No:
Product Description
Catalog Number:
AG000DGX
Chemical Name:
1,2-Butanediol, 4-[[(1,1-dimethylethyl)diphenylsilyl]oxy]-, (2S)-
CAS Number:
116996-52-2
Molecular Formula:
C20H28O3Si
Molecular Weight:
344.5200
IUPAC Name:
(2S)-4-[tert-butyl(diphenyl)silyl]oxybutane-1,2-diol
InChI:
InChI=1S/C20H28O3Si/c1-20(2,3)24(18-10-6-4-7-11-18,19-12-8-5-9-13-19)23-15-14-17(22)16-21/h4-13,17,21-22H,14-16H2,1-3H3/t17-/m0/s1
InChI Key:
HOTHUPHQAFZSMY-KRWDZBQOSA-N
SMILES:
OC[C@H](CCO[Si](C(C)(C)C)(c1ccccc1)c1ccccc1)O
Properties
Complexity:
336
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
344.181g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
344.526g/mol
Monoisotopic Mass:
344.181g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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