METHYL2-KETOBUTYRATE,96
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METHYL2-KETOBUTYRATE,96
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CAS No:
3952-66-7
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Formula:
C5H8O3
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Chemical Name:
METHYL2-KETOBUTYRATE,96
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Synonyms:
Methyl2-Oxobutyrate;Methyl-2-oxobutanoate;Methyl2-oxobutanoate95%;METHYL2-KETOBUTYRATE,96;2-Oxobutyricacidmethylester;2-Oxobutanoicacidmethylester;2-Ketobutyricacidmethylester~Methylmethylpyruvate~Methyl2-oxobutyrate~Methylpyruvicacidmethylester~2-Oxobutyric
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CAS No:
Safety Information
Ⅲ
1993
3
3
26-36/37
Xi
P261-P305 + P351 + P338-P342 + P311
H226-H319-H334
|Danger|H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P261, P264, P272, P280, P285, P302+P352, P303+P361+P353, P304+P341, P305+P351+P338, P321, P333+P313, P337+P313, P342+P311, P363, P370+P378, P403+P235, and P501|Aggregated GHS information provided by 73 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
METHYL2-KETOBUTYRATE,96 Use and Manufacturing
2-Oxobutanoic Acid Methyl Ester was found as a volatile constituent of curuba fruit and was screened for potential biological activity.
Computed Properties
Molecular Weight:116.11
XLogP3:0.5
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:116.047344113
Monoisotopic Mass:116.047344113
Topological Polar Surface Area:43.4
Heavy Atom Count:8
Complexity:106
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
