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2-Hydroxy-1-phenyl-1-propanone

CAT: 0572-TRC-H950250-250MGSize: 250 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-H950250-250MGSize:250 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
5650-40-8
Synonyms
1-Propanone, 2-hydroxy-1-phenyl-; Propiophenone, 2-hydroxy- (7CI,8CI); Propiophenone, α-hydroxy- (3CI); 2-Hydroxy-1-phenyl-1-propanone; 1-Hydroxyethyl phenyl ketone; 1-Phenyl-2-hydroxy-1-propanone; 2-Hydroxypropiophenone; Benzoylmethylcarbinol; Lactophenone; Methanol, benzoylmethyl-; NSC 402216; α-Hydroxypropiophenone
Hazard Statement
Not a hazardous substance according to GHS.
Purity
>95% (HPLC)
Smiles
CC(O)C(=O)c1ccccc1
Molecular Formula
C9 H10 O2
Molecular Weight
150.17
InChI
InChI=1S/C9H10O2/c1-7(10)9(11)8-5-3-2-4-6-8/h2-7,10H,1H3
Additionnal Information
IUPAC name: 2-hydroxy-1-phenylpropan-1-one
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

2-Hydroxy-1-phenyl-1-propanone

2-hydroxy-1-phenyl-1-propanone is an alpha-oxyketone that consists of propiophenone bearing an alpha-hydroxy substituent. It is a secondary alpha-hydroxy ketone and an aromatic ketone. It is functionally related to a propiophenone.

CAS Number5650-40-8
PubChem CID101121
IUPAC Name2-hydroxy-1-phenylpropan-1-one
Molecular FormulaC9H10O2
Molecular Weight150.17
XLogP1.4
Topological Polar Surface Area37.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count11
Formal Charge0
Complexity136
SMILES
CC(C(=O)C1=CC=CC=C1)O
InChI
InChI=1S/C9H10O2/c1-7(10)9(11)8-5-3-2-4-6-8/h2-7,10H,1H3
InChIKey
WLVPRARCUSRDNI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Hydroxy-1-phenyl-1-propanone
CAS: 5650-40-8
CID: 101121
Formula: C9H10O2
MW: 150.17
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight150.17
XLogP31.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass150.068079557
Monoisotopic Mass150.068079557
Topological Polar Surface Area37.3 Ų
Heavy Atom Count11
Formal Charge0
Complexity136
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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