-
Name
Propanoic acid, 2-bromo-, ethyl ester, (2S)-
- EINECS
- CAS No. 30365-54-9
- Article Data6
- CAS DataBase
- Density 1.413 g/cm3
- Solubility
- Melting Point
- Formula C5H9BrO2
- Boiling Point 171 °C at 760 mmHg
- Molecular Weight 181.029
- Flash Point 58.4 °C
- Transport Information
- Appearance
- Safety
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms 2-Bromobutyric acid methyl ester;
- PSA
- LogP
Propanoic acid, 2-bromo-, ethyl ester, (2S)- Specification
The CAS registry number of Propanoic acid, 2-bromo-, ethyl ester, (2S)- is 30365-54-9. This chemical is also named as 2-Bromobutyric acid methyl ester. In addition, its molecular formula is C5H9BrO2 and molecular weight is 181.0278. Its systematic name is called methyl 2-bromobutanoate.
Physical properties about Propanoic acid, 2-bromo-, ethyl ester, (2S)- are: (1)ACD/LogP: 1.72; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.72; (4)ACD/LogD (pH 7.4): 1.72; (5)ACD/BCF (pH 5.5): 11.88; (6)ACD/BCF (pH 7.4): 11.88; (7)ACD/KOC (pH 5.5): 204.66; (8)ACD/KOC (pH 7.4): 204.66; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Index of Refraction: 1.453; (13)Molar Refractivity: 34.67 cm3; (14)Molar Volume: 128.1 cm3; (15)Surface Tension: 32.2 dyne/cm; (16)Density: 1.413 g/cm3; (17)Flash Point: 58.4 °C; (18)Enthalpy of Vaporization: 40.74 kJ/mol; (19)Boiling Point: 171 °C at 760 mmHg; (20)Vapour Pressure: 1.43 mmHg at 25°C.
Uses of Propanoic acid, 2-bromo-, ethyl ester, (2S)-: it can be used to produce 2,2'-p-phenylenedioxy-di-propionic acid diethyl ester by heating. It will need reagent K2CO3 and solvent acetonitrile with reaction time of 14 hours. The yield is about 82 %.
-.png)
You can still convert the following datas into molecular structure:
(1)SMILES: BrC(C(=O)OC)CC
(2)InChI: InChI=1/C5H9BrO2/c1-3-4(6)5(7)8-2/h4H,3H2,1-2H3
(3)InChIKey: UFQQDNMQADCHGH-UHFFFAOYAF
Related Products
- Propanoic acid, 1-methylpropyl ester
- Propanoic acid, 2-(2,4-dichlorophenoxy)-, magnesium salt (2:1)
- Propanoic acid, 2-(2,4-dichlorophenoxy)-, mixt. with (2,4-dichlorophenoxy)acetic acid, (2,4,5-trichlorophenoxy)acetic acid and 2-(2,4,5-trichlorophenoxy)propanoic acid
- Propanoic acid, 2-[4-(trifluoromethoxy)phenoxy]-
- Propanoic acid, 2-bromo-, ethyl ester, (2S)-
- Propanoic acid, 2-chloro-3-methoxy-
- Propanoic acid, 2-hydroxy-, decylester
- Propanoic acid, 2-hydroxy-3-(phenylmethoxy)-, methyl ester, (2R)-
- Propanoic acid, 2-iodo-2-methyl-, methyl ester
- Propanoic acid, 2-methoxy-, ethyl ester, (2R)-
- 30368-49-1
- 30369-70-1
- 30369-73-4
- 30369-82-5
- 30374-35-7
- 30375-08-7
- 3037-56-7
- 303763-37-3
- 30377-52-7
Hot Products
About|Contact|Cas|Product Name|Molecular|Country|Encyclopedia
Message|New Cas|MSDS|Service|Advertisement|CAS DataBase|Article Data|Manufacturers | Chemical Catalog
©2008 LookChem.com,License: ICP
NO.:Zhejiang16009103
complaints:service@lookchem.com Desktop View