3-Hydroxy-2-methylbutyric acid
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3-Hydroxy-2-methylbutyric acid
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CAS No:
473-86-9
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Formula:
C5H10O3
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Chemical Name:
3-Hydroxy-2-methylbutyric acid
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Synonyms:
Butanoic acid,3-hydroxy-2-methyl-;Butyric acid,3-hydroxy-2-methyl-;3-Hydroxy-2-methylbutanoic acid;α-Methyl-β-hydroxybutyric acid;3-Hydroxy-2-methylbutyric acid;2-Methyl-3-hydroxybutyric acid;Nilic acid;1111093-30-1
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CAS No:
Description
Pale orange Oil
Solid
3-hydroxy-2-methylbutanoic acid is a 3-hydroxy monocarboxylic acid that is butyric acid which is substituted by a methyl group and a hydroxy group at positions 2 and 3, respectively. It derives from a butyric acid. It is a conjugate acid of a 2-methyl-3-hydroxybutyrate.
Characteristics
57.53000
0.08790
Solid
1.136g/cm3
242.8ºC at 760mmHg
114.9ºC
1.455
Refrigerator
0.00567mmHg at 25°C
Safety Information
|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
3-Hydroxy-2-methylbutyric acid Use and Manufacturing
Fatty Acyls [FA] -> Fatty Acids and Conjugates [FA01] -> Hydroxy fatty acids [FA0105]
Computed Properties
Molecular Weight:118.13
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:118.062994177
Monoisotopic Mass:118.062994177
Topological Polar Surface Area:57.5
Heavy Atom Count:8
Complexity:89.7
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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