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3'-Hydroxy-4'-Methylacetophenone

CAT: 0013-GTR19258844-05Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19258844-05Size:50 mg
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Description
3'-Hydroxy-4'-Methylacetophenone is a colorless or pale yellow liquid characterized by a distinct aromatic odor. This polar compound demonstrates solubility in alcohol, ether, ketone, and ester solvents.
CAS Number
33414-49-2
Product Name Alternative
1- (3-Hydroxy-4-methylphenyl) ethanone, 1- (3-hydroxy-4-methyl-phenyl) ethanone
Purity
99.81% (May vary between batches)
Smiles
O=C (C1=CC=C (C (O) =C1) C) C
Molecular Formula
C9H10O2
Molecular Weight
150.17
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

1-(3-Hydroxy-4-methylphenyl)ethanone
CAS Number33414-49-2
PubChem CID12282261
IUPAC Name1-(3-hydroxy-4-methylphenyl)ethanone
Molecular FormulaC9H10O2
Molecular Weight150.17
XLogP1.7
Topological Polar Surface Area37.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count11
Formal Charge0
Complexity154
SMILES
CC1=C(C=C(C=C1)C(=O)C)O
InChI
InChI=1S/C9H10O2/c1-6-3-4-8(7(2)10)5-9(6)11/h3-5,11H,1-2H3
InChIKey
MFJCFSDSJMSMQK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-(3-Hydroxy-4-methylphenyl)ethanone
CAS: 33414-49-2
CID: 12282261
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 Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass150.068079557
Monoisotopic Mass150.068079557
Topological Polar Surface Area37.3 Ų
Heavy Atom Count11
Formal Charge0
Complexity154
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

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T206000-013'-Hydroxy-4'-Methylacetophenone
TRC-H946870-1G4'-Hydroxy-3'-methylacetophenone
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sc-2312522'-Hydroxy-4'-methylacetophenone
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