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100642-59-9

100642-59-9 | Benzenemethanol, 2-[(trimethylsilyl)methyl]-, 1-acetate

CAS No: 100642-59-9 Catalog No: AG0002J8 MDL No:

Product Description

Catalog Number:
AG0002J8
Chemical Name:
Benzenemethanol, 2-[(trimethylsilyl)methyl]-, 1-acetate
CAS Number:
100642-59-9
Molecular Formula:
C13H20O2Si
Molecular Weight:
236.3822
IUPAC Name:
acetic acid;[2-(trimethylsilylmethyl)phenyl]methanol
InChI:
InChI=1S/C11H18OSi.C2H4O2/c1-13(2,3)9-11-7-5-4-6-10(11)8-12;1-2(3)4/h4-7,12H,8-9H2,1-3H3;1H3,(H,3,4)
InChI Key:
QDBVICXMZJQYGU-UHFFFAOYSA-N
SMILES:
CC(=O)OCc1ccccc1C[Si](C)(C)C

Properties

Complexity:
182  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.134g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
254.401g/mol
Monoisotopic Mass:
254.134g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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