China (Mainland)
Ethyl acetylphenylacetate CAS NO.5413-05-8
- Min.Order: 0 Metric Ton
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Keywords
- 5413-05-8
Quick Details
- ProName: Ethyl acetylphenylacetate
- CasNo: 5413-05-8
- Molecular Formula: C12H14O3
- Appearance: Colorless to slight yellow liquid
- DeliveryTime: In stock
- PackAge: 25kg/NET Plastic Drum
- ProductionCapacity: 10 Metric Ton/Year
- Purity: ≥96%(GC)
- Storage: Store in a cool, dry area. Keep contai...
- Transportation: NOT RESTRICTED
- LimitNum: 0 Metric Ton
Superiority
Package & Delivery Time
Package:25kg/NET Plastic Drum
Delivery Time: In stock
Details
Package & Delivery Time
Package: 25kg/NET Plastic Drum
Delivery Time: In stock.jpg "Packaging of 5413-05-8 Ethyl acetylphenylacetate")
Our 99% Ethyl acetylphenylacetate
*Synonyms: 2-Phenylacetoacetic acid ethyl ester; ethyl 3-oxo-2-phenylbutanoate; ethyl (2S)-3-oxo-2-phenylbutanoate
*Formula: C12H14O3
*M.W.: 206.24
*Feature: bp 140-144°C 10mmHg ，d420 1.085 g/cm3 ，nd20 1.503，fp 119°C.
Our Ethyl acetylphenylacetate is ≥96%(GC). The specification of it is showed as follows:
| Product Name | Ethyl acetylphenylacetate |
| CAS NO. | 5413-05-8 |
| Appearance | Colorless to slight yellow liquid |
| Assay | ≥96%(GC) |
| Min. Order | -- |
| Production Capacity | 10 tons per year |
Usage of Ethyl acetylphenylacetate
Ethyl acetylphenylacetate (CAS NO.5413-05-8) is a Aromatics Compounds.
Other Information of Ethyl acetylphenylacetate
1. Introduction of Ethyl acetylphenylacetate
Ethyl acetylphenylacetate (CAS NO.5413-05-8) is a colorless to slight yellow liquid. The IUPAC Name of this chemical is ethyl 3-oxo-2-phenylbutanoate. Besides, the Product Categories of it is Aromatics Compounds.
2. Basic information of Ethyl acetylphenylacetate
1) Properties:
(1)XLogP3-AA: 2; (2)H-Bond Donor: 0; (3)H-Bond Acceptor: 3; (4)Rotatable Bond Count: 5; (5)Tautomer Count: 5; (6)Exact Mass: 206.094294; (7)MonoIsotopic Mass: 206.094294; (8)Topological Polar Surface Area: 43.4; (9)Heavy Atom Count: 15; (10)Formal Charge: 0; (11)Complexity: 229; (12)Isotope Atom Count: 0; (13)Defined Atom Stereocenter Count: 0; (14)Undefined Atom Stereocenter Count: 1; (15)Defined Bond Stereocenter Count: 0; (16)Undefined Bond Stereocenter Count: 0; (17)Covalently-Bonded Unit Count: 1; (18)Feature 3D Acceptor Count: 2; (19)Feature 3D Anion Count: 1; (20)Feature 3D Ring Count: 1; (21)Effective Rotor Count: 5; (22)Conformer Sampling RMSD: 0.6.
2) Descriptors of Structure
InChI: InChI=1S/C12H14O3/c1-3-15-12(14)11(9(2)13)10-7-5-4-6-8-10/h4-8,11H,3H2,1-2H3
InChIKey: PWRUKIPYVGHRFL-UHFFFAOYSA-N
Canonical SMILES: CCOC(=O)C(C1=CC=CC=C1)C(=O)C
Smiles: C([C@@H](C(=O)C)c1ccccc1)(=O)OCC
