2,3-dihydroxybutanoic acid;methane;yttrium

C6H16O4Y — CID 159544972

IUPAC2,3-dihydroxybutanoic acid;methane;yttrium
SMILESC.C.CC(O)C(O)C(=O)O.[Y]
InChIInChI=1S/C4H8O4.2CH4.Y/c1-2(5)3(6)4(7)8;;;/h2-3,5-6H,1H3,(H,7,8);2*1H4;
InChIKeyIGEWTTDXMZZPJO-UHFFFAOYSA-N
MW241.10 g/mol
LogP0.08
Rot. Bonds2

About 2,3-dihydroxybutanoic acid;methane;yttrium

2,3-dihydroxybutanoic acid;methane;yttrium (PubChem CID 159544972) has the molecular formula C6H16O4Y and a molecular weight of 241.10 g/mol. Its IUPAC name is 2,3-dihydroxybutanoic acid;methane;yttrium.

Molecular Properties

Compound Name2,3-dihydroxybutanoic acid;methane;yttrium
PubChem CID159544972
Molecular FormulaC6H16O4Y
Molecular Weight241.10 g/mol
Exact Mass241.01
IUPAC Name2,3-dihydroxybutanoic acid;methane;yttrium
SMILESC.C.CC(O)C(O)C(=O)O.[Y]
InChIInChI=1S/C4H8O4.2CH4.Y/c1-2(5)3(6)4(7)8;;;/h2-3,5-6H,1H3,(H,7,8);2*1H4;
InChIKeyIGEWTTDXMZZPJO-UHFFFAOYSA-N
XLogP0.08
TPSA77.76 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.10
LogP ≤ 50.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2S,3S,4S)-2,4-dihydroxy-3-methylpentanoic acid
CID 155797991
(2S,3S)-2,4-dihydroxy-3-methylpentanoic acid
CID 139665341
(2R,3S)-2,4-dihydroxy-3-methylpentanoic acid
CID 139665346
(2R,3S,4S,5R)-2,3,4,5-tetrahydroxyhexanoic acid
CID 5459874
CID 170844591
CID 170844591
(2S,3R)-2,3-dihydroxy-4-methylpentanoic acid
CID 11137318
(4S)-4-hydroxy-2,3-dimethylpentanoic acid
CID 146599798
(2R,3R)-3-amino-2-hydroxybutanoic acid
CID 10997015
2-hydroxy-4-methyl-3-propan-2-ylpentanoic acid
CID 141142510
alumane;2,3-dihydroxybutanedioic acid
CID 173001814
2,3-dihydroxybutanedioic acid;rhodium
CID 88806318
2-hydroxypropanoic acid
CID 87075455

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydroxybutanoic acid;methane;yttrium?
The IUPAC name of 2,3-dihydroxybutanoic acid;methane;yttrium (CID 159544972) is 2,3-dihydroxybutanoic acid;methane;yttrium.
What is the SMILES notation for 2,3-dihydroxybutanoic acid;methane;yttrium?
The canonical SMILES for 2,3-dihydroxybutanoic acid;methane;yttrium is C.C.CC(O)C(O)C(=O)O.[Y].
What is the InChIKey of 2,3-dihydroxybutanoic acid;methane;yttrium?
The InChIKey is IGEWTTDXMZZPJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8O4.2CH4.Y/c1-2(5)3(6)4(7)8;;;/h2-3,5-6H,1H3,(H,7,8);2*1H4;.
What are the key properties of 2,3-dihydroxybutanoic acid;methane;yttrium?
2,3-dihydroxybutanoic acid;methane;yttrium has a molecular weight of 241.10 g/mol, XLogP of 0.08, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydroxybutanoic acid;methane;yttrium is sourced from PubChem (CID 159544972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).