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2,2-Dimethoxy-2-Phenylacetophenone

CAT: 1596-AR-A01250-02Size: 25 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-A01250-02Size:25 Units
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CAS Number
24650-42-8
Synonyms
2,2-dimethoxy-1,2-diphenylethanone;2,2-Dimethoxy-1,2-diphenylethanone; Benzil Dimethyl Acetal; 1,2-Diphenyl-2,2-dimethoxyethanone; 2,2-Dimethoxy-1,2-diphenyl-1-ethanone; 2-Phenyl-2,2-dimethoxyacetophenone; Aronix C 101; BDK; Benzil Dimethyl Ketal; Benzoin Dimethyl Ether; C 101; DMPA; Esacure; Quantacure BDK; SB-PI 718; ?, ?-Dimethoxy-?-phenylacetophenone
Molecular Formula
C16H16O3
Molecular Weight
256.3
API Name
Acetophenone

Chemical Information

2,2-Dimethoxy-2-phenylacetophenone

2,2-dimethoxy-2-phenylacetophenone has been reported in Camellia sinensis with data available.

CAS Number24650-42-8
PubChem CID90571
IUPAC Name2,2-dimethoxy-1,2-diphenylethanone
Molecular FormulaC16H16O3
Molecular Weight256.30
XLogP3
Topological Polar Surface Area35.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Heavy Atom Count19
Formal Charge0
Complexity284
SMILES
COC(C1=CC=CC=C1)(C(=O)C2=CC=CC=C2)OC
InChI
InChI=1S/C16H16O3/c1-18-16(19-2,14-11-7-4-8-12-14)15(17)13-9-5-3-6-10-13/h3-12H,1-2H3
InChIKey
KWVGIHKZDCUPEU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,2-Dimethoxy-2-phenylacetophenone
CAS: 24650-42-8
CID: 90571
Formula: C16H16O3
MW: 256.30
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight256.30
XLogP33
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Exact Mass256.109944368
Monoisotopic Mass256.109944368
Topological Polar Surface Area35.5 Ų
Heavy Atom Count19
Formal Charge0
Complexity284
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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