Cas no 42253-99-6 (Benzeneacetic acid, a-methyl-, ethyl ester, (aS)-)
42253-99-6 structure
Product Name:Benzeneacetic acid, a-methyl-, ethyl ester, (aS)-
CAS No:42253-99-6
MF:C11H14O2
MW:178.227663516998
CID:325038
PubChem ID:6933646
Update Time:2025-04-19
Benzeneacetic acid, a-methyl-, ethyl ester, (aS)- Chemical and Physical Properties
Names and Identifiers
-
- Benzeneacetic acid, a-methyl-, ethyl ester, (aS)-
- (R)-2-PHENYLPROPIONATE ETHYL
- (R)-PhCHMeCO2Et
- Ethyl (2R)-2-Phenylpropanoate
- (R)-ethyl 2-phenylpropanoate
- TS-00188
- SCHEMBL10756249
- ethyl (R)-2-phenylpropanoate
- AKOS017343338
- 42253-99-6
-
- Inchi： 1S/C11H14O2/c1-3-13-11(12)9(2)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3/t9-/m1/s1
- InChI Key： UTUVIKZNQWNGIM-SECBINFHSA-N
- SMILES： O(CC)C([C@H](C)C1C=CC=CC=1)=O
Computed Properties
- Exact Mass: 178.09900
- Monoisotopic Mass: 178.099379685g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 4
- Complexity: 160
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.7
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- Density: 1.012
- Boiling Point: 232.2°C at 760 mmHg
- Flash Point: 93.6°C
- Refractive Index: 1.496
- PSA: 26.30000
- LogP: 2.35320
Benzeneacetic acid, a-methyl-, ethyl ester, (aS)- Customs Data
- HS CODE：2916399090
- Customs Data：
China Customs Code:
2916399090Overview:
2916399090 Other aromatic monocarboxylic acids. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%
Declaration elements:
Product Name, component content, use to, Acrylic acid\Acrylates or esters shall be packaged clearly
Summary:
2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%
Benzeneacetic acid, a-methyl-, ethyl ester, (aS)- Related Literature
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
-
Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
-
Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
-
Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
42253-99-6 (Benzeneacetic acid, a-methyl-, ethyl ester, (aS)-) Related Products
- 2901-13-5(Ethyl Dimethylphenylacetate)
- 3469-00-9(Methyl 2,2-Diphenylacetate)
- 111170-56-0(Benzeneacetic acid, a-methyl-, ethyl ester, (aR)-)
- 17838-69-6(Ethyl 3-oxo-2-Phenylpropanoate)
- 14510-36-2(Acetyltropic Acid)
- 83-13-6(Diethyl phenylmalonate)
- 102-13-6(Isobutyl 2-phenylacetate)
- 103-48-0(phenethyl isobutyrate)
- 57625-74-8(Methyl Dimethylbenzeneacetate)
- 17097-90-4(3-Ethoxy-3-oxo-2-phenylpropanoic acid)
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