Cas no 55004-59-6 (ethyl 2-bromo-2-phenylpropanoate)
55004-59-6 structure
Product Name:ethyl 2-bromo-2-phenylpropanoate
CAS No:55004-59-6
MF:C11H13BrO2
MW:257.123722791672
CID:943192
PubChem ID:3778911
Update Time:2025-04-19
ethyl 2-bromo-2-phenylpropanoate Chemical and Physical Properties
Names and Identifiers
-
- ethyl 2-bromo-2-phenylpropanoate
- 2-Brom-2-phenyl-propionsaeure-aethylester
- 2-bromo-2-phenylpropionic acid ethyl ester
- ethyl 2-bromo-2-phenylpropionate
- OXUBOOPFXQOMBI-UHFFFAOYSA-N
- DA-34331
- ethyl 2-bromo-2-phenyl-propionate
- 55004-59-6
- Ethyl-2-bromo-2-phenylpropanoate
- SCHEMBL9725190
- MFCD02180855
- DTXSID10396305
-
- Inchi： 1S/C11H13BrO2/c1-3-14-10(13)11(2,12)9-7-5-4-6-8-9/h4-8H,3H2,1-2H3
- InChI Key： OXUBOOPFXQOMBI-UHFFFAOYSA-N
- SMILES： BrC(C(=O)OCC)(C)C1C=CC=CC=1
Computed Properties
- Exact Mass: 256.01000
- Monoisotopic Mass: 256.01
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 4
- Complexity: 200
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.2
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- Density: 1,34 g/cm3
- Boiling Point: 283.7°C at 760 mmHg
- Flash Point: 125.4°C
- Refractive Index: 1.533
- PSA: 26.30000
- LogP: 2.85980
ethyl 2-bromo-2-phenylpropanoate Security Information
- Hazard Category Code： 36/37/38
- Safety Instruction： S26; S36/37/39
-
Hazardous Material Identification：
- Risk Phrases：R36/37/38
ethyl 2-bromo-2-phenylpropanoate 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%
ethyl 2-bromo-2-phenylpropanoate Related Literature
-
James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
-
Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
-
R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
-
Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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