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102308-33-8 | 1,3-Butadien-2-ol, 1-methoxy-3-[(trimethylsilyl)oxy]-, 2-acetate, (1Z)-
CAS No: 102308-33-8 Catalog No: AG00076A MDL No:
Product Description
Catalog Number:
AG00076A
Chemical Name:
1,3-Butadien-2-ol, 1-methoxy-3-[(trimethylsilyl)oxy]-, 2-acetate, (1Z)-
CAS Number:
102308-33-8
Molecular Formula:
C10H18O4Si
Molecular Weight:
230.3330
IUPAC Name:
acetic acid;1-methoxy-3-trimethylsilyloxybuta-1,3-dien-2-ol
InChI:
InChI=1S/C8H16O3Si.C2H4O2/c1-7(8(9)6-10-2)11-12(3,4)5;1-2(3)4/h6,9H,1H2,2-5H3;1H3,(H,3,4)
InChI Key:
YLOUIYSHCUUDQB-UHFFFAOYSA-N
SMILES:
CO/C=C(/C(=C)O[Si](C)(C)C)\OC(=O)C
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.108g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
248.35g/mol
Monoisotopic Mass:
248.108g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
76A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
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