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4-tert-Butyldimethylsiloxyacetophenone

CAT: 0572-TRC-B942803-5GSize: 5 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-B942803-5GSize:5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
149683-53-4
Hazard Statement
No Data Available
Smiles
CC(=O)c1ccc(O[Si](C)(C)C(C)(C)C)cc1
Molecular Formula
C14 H22 O2 Si
Molecular Weight
250.409
InChI
InChI=1S/C14H22O2Si/c1-11(15)12-7-9-13(10-8-12)16-17(5,6)14(2,3)4/h7-10H,1-6H3
Additionnal Information
IUPAC name: 1-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]ethanone
Shipping Conditions
Room Temperature

Chemical Information

Ethanone, 1-[4-[[(1,1-dimethylethyl)dimethylsilyl]oxy]phenyl]-
CAS Number149683-53-4
PubChem CID10857908
IUPAC Name1-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]ethanone
Molecular FormulaC14H22O2Si
Molecular Weight250.41
Topological Polar Surface Area26.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Heavy Atom Count17
Formal Charge0
Complexity270
SMILES
CC(=O)C1=CC=C(C=C1)O[Si](C)(C)C(C)(C)C
InChI
InChI=1S/C14H22O2Si/c1-11(15)12-7-9-13(10-8-12)16-17(5,6)14(2,3)4/h7-10H,1-6H3
InChIKey
GPJCOEQTQFSCML-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ethanone, 1-[4-[[(1,1-dimethylethyl)dimethylsilyl]oxy]phenyl]-
CAS: 149683-53-4
CID: 10857908
Formula: C14H22O2Si
MW: 250.41
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight250.41
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass250.138906475
Monoisotopic Mass250.138906475
Topological Polar Surface Area26.3 Ų
Heavy Atom Count17
Formal Charge0
Complexity270
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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