(S)-2-ethyl-2-hydroxy-3-methyl-but-3-enoic acid

HCID 11636818
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Basic information

Standard SMILES
C=C(C)[C@@](O)(CC)C(=O)O
InChIKey
CXEZODQMCZFRBQ-ZETCQYMHSA-N
Molecular formula
C7H12O3
Average molar mass
144.17 g/mol
Monoisotopic mass
144.07864424

Names & identifiers

Preferred name
(S)-2-ethyl-2-hydroxy-3-methyl-but-3-enoic acid
IUPAC
(2S)-2-ethyl-2-hydroxy-3-methylbut-3-enoic acid

Names & synonyms

SCHEMBL4845519CXEZODQMCZFRBQ-ZETCQYMHSA-NAKOS006379440(S)-2-ethyl-2-hydroxy-3-methyl-but-3-enoic acid

Database identifiers

PubChem CID
11636818

Properties

Computed structural properties

XLogP
1.3
Topological polar surface area
57.5 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
10

Related reactions

1 records
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Compound notes

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