Butanoic acid, 2-bromo-, ethyl ester
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Butanoic acid, 2-bromo-, ethyl ester
structure -
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CAS No:
533-68-6
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Formula:
C6H11BrO2
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Chemical Name:
Butanoic acid, 2-bromo-, ethyl ester
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Synonyms:
Butanoic acid,2-bromo-,ethyl ester;Butyric acid,2-bromo-,ethyl ester;Butyric acid,α-bromo-,ethyl ester;Ethyl α-bromobutyrate;Ethyl 2-bromobutyrate;Ethyl 2-bromobutanoate;2-Bromobutanoic acid ethyl ester;2-Bromobutyric acid ethyl ester;NSC 8855;Ethyl bromobutanoate;66025-42-1;2374896-06-5
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CAS No:
Characteristics
26.3
2.2
Clear liquid
1.3263 g/cm3 @ Temp: 11.5 °C
142-144 °C @ Solvent: Water
177 °C
137 °F
1.446-1.448
Insoluble in water. Miscible with alcohol and ether
0-6°C
Safety Information
III
3
UN 1993 3/PG 3
3
22-37/38-41-36/37/38
26-39-24/25-23
Xn,Xi
Stable under normal temperatures and pressures.
P210, P233, P240, P241, P242, P243, P261, P264, P270, P271, P280, P301+P312, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P370+P378, P403+P233, P403+P235, P405, P501
H226
|Danger|H226 (95.92%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P261, P264, P270, P271, P280, P301+P312, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501|Aggregated GHS information provided by 49 companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Butanoic acid, 2-bromo-, ethyl ester Use and Manufacturing
Used as pesticide and pharmaceutical intermediate
Butanoic acid, 2-bromo-, ethyl ester: ACTIVE
Computed Properties
Molecular Weight:195.05
XLogP3:2.2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:193.99424
Monoisotopic Mass:193.99424
Topological Polar Surface Area:26.3
Heavy Atom Count:9
Complexity:93.1
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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