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4''-Methoxyacetophenone

CAT: 0862-GK6399-25gSize: 25 gDry Ice: NoHazardous: No
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CAT#:0862-GK6399-25gSize:25 g
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CAS Number
100-06-1
EC Number
202-815-9
MDL Number
MFCD00008745
HS Code
29145000
Purity
99.00%
Molecular Formula
C9H10O2
Molecular Weight
150.18
Storage Conditions
+20°C
Hazardous Class
Not hazardous

Chemical Information

4'-Methoxyacetophenone

4-methoxyacetophenone is a member of the class of acetophenones that is acetophenone substituted by a methoxy group at position 4. It is a member of acetophenones and a monomethoxybenzene.

CAS Number100-06-1
PubChem CID7476
IUPAC Name1-(4-methoxyphenyl)ethanone
Molecular FormulaC9H10O2
Molecular Weight150.17
XLogP1.7
Topological Polar Surface Area26.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count11
Formal Charge0
Complexity134
SMILES
CC(=O)C1=CC=C(C=C1)OC
InChI
InChI=1S/C9H10O2/c1-7(10)8-3-5-9(11-2)6-4-8/h3-6H,1-2H3
InChIKey
NTPLXRHDUXRPNE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4'-Methoxyacetophenone
CAS: 100-06-1
CID: 7476
Formula: C9H10O2
MW: 150.17
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight150.17
XLogP31.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass150.068079557
Monoisotopic Mass150.068079557
Topological Polar Surface Area26.3 Ų
Heavy Atom Count11
Formal Charge0
Complexity134
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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Alternative Products

CatalogName
434003-014'-Methoxyacetophenone
283247-014-Methoxyacetophenone
CS-T-576154'-Methoxyacetophenone-d5
HY-Y0024R-014-Methoxyacetophenone (Standard)
CS-O-424352'-FLUORO-4'-METHOXYACETOPHENONE
1608493’-Fluoro-4’methoxyacetophenone
MBS57526173-Hydroxy-4-methoxyacetophenone
OR13025-013'-Iodo-4'-methoxyacetophenone
sc-2603232'-Amino-4'-methoxyacetophenone
OR8814-014'-Hydroxy-2'-methoxyacetophenone

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