2-Hydroxy-3-methylbutanedioic acid
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2-Hydroxy-3-methylbutanedioic acid
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CAS No:
608-41-3
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Formula:
C5H8O5
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Chemical Name:
2-Hydroxy-3-methylbutanedioic acid
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Synonyms:
Butanedioic acid,2-hydroxy-3-methyl-;Malic acid,3-methyl-;2-Hydroxy-3-methylbutanedioic acid;β-Methylmalic acid;3-Methylmalic acid;2-Hydroxy-3-methylsuccinic acid;5380-36-9;5380-37-0;23394-53-8
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CAS No:
Description
3-methylmalic acid is a dicarboxylic acid that is succinic acid carrying hydroxy and methyl substituents at positions 2 and 3 respectively It has a role as a human metabolite. It is a dicarboxylic acid and a lipid. It derives from a succinic acid. It is a conjugate acid of a 3-methylmalate(2-).
Safety Information
|Danger|H318 (97.44%): Causes serious eye damage [Danger Serious eye damage/eye irritation]|P280, P305+P351+P338, and P310|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:148.11
XLogP3:-0.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:148.03717335
Monoisotopic Mass:148.03717335
Topological Polar Surface Area:94.8
Heavy Atom Count:10
Complexity:152
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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