Ethyl (2E)-3-methyl-4-oxo-2-butenoate
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Ethyl (2E)-3-methyl-4-oxo-2-butenoate
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CAS No:
62054-49-3
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Formula:
C7H10O3
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Chemical Name:
Ethyl (2E)-3-methyl-4-oxo-2-butenoate
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Synonyms:
2-Butenoic acid,3-methyl-4-oxo-,ethyl ester,(2E)-;2-Butenoic acid,3-methyl-4-oxo-,ethyl ester,(E)-;Fumaraldehydic acid,3-methyl-,ethyl ester;Ethyl (2E)-3-methyl-4-oxo-2-butenoate;Ethyl (E)-3-methyl-4-oxocrotonate;Ethyl trans-3-methyl-4-oxo-2-butenoate;Ethyl trans-3-methyl-4-oxocrotonate;Ethyl (E)-4-oxo-3-methyl-2-butenoate;Ethyl (E)-3-methyl-4-oxo-2-butenoate;Ethyl (2E)-3-methyl-4-oxobut-2-enoate;Ethyl (E)-3-methyl-4-oxo-2-butenoate;Ethyl trans-3-methyl-4-oxo-2-butenoate;1244977-78-3;1558450-61-5
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CAS No:
Safety Information
NONH for all modes of transport
3
36/37/38
23-24/25-36-26
Xi
P264, P273, P280, P302+P352, P305+P351+P338, P310, P321, P332+P313, P362, P501
H315
|Danger|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P273, P280, P302+P352, P305+P351+P338, P310, P321, P332+P313, P362, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Ethyl (2E)-3-methyl-4-oxo-2-butenoate Use and Manufacturing
Derivative of monoenoic and trienoic analogs of Sorbic Acid with antifungal activity.
Computed Properties
Molecular Weight:142.15
XLogP3:0.6
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:142.062994177
Monoisotopic Mass:142.062994177
Topological Polar Surface Area:43.4
Heavy Atom Count:10
Complexity:158
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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Ethyl (2E)-3-methyl-4-oxo-2-butenoate
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