(Z)-but-2-enoic acid;yttrium

C4H6O2Y — CID 58782397

IUPAC(Z)-but-2-enoic acid;yttrium
SMILESC/C=C\C(=O)O.[Y]
InChIInChI=1S/C4H6O2.Y/c1-2-3-4(5)6;/h2-3H,1H3,(H,5,6);/b3-2-;
InChIKeyIQAFYOQQPXIBCD-OLGQORCHSA-N
MW175.00 g/mol
LogP0.64
Rot. Bonds1

About (Z)-but-2-enoic acid;yttrium

(Z)-but-2-enoic acid;yttrium (PubChem CID 58782397) has the molecular formula C4H6O2Y and a molecular weight of 175.00 g/mol. Its IUPAC name is (Z)-but-2-enoic acid;yttrium.

Molecular Properties

Compound Name(Z)-but-2-enoic acid;yttrium
PubChem CID58782397
Molecular FormulaC4H6O2Y
Molecular Weight175.00 g/mol
Exact Mass174.94
IUPAC Name(Z)-but-2-enoic acid;yttrium
SMILESC/C=C\C(=O)O.[Y]
InChIInChI=1S/C4H6O2.Y/c1-2-3-4(5)6;/h2-3H,1H3,(H,5,6);/b3-2-;
InChIKeyIQAFYOQQPXIBCD-OLGQORCHSA-N
XLogP0.64
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.00
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

(E)-but-2-enoic acid
CID 637090
(Z)-but-2-ene;(Z)-but-2-enoic acid
CID 158994925
but-2-enoic acid;phosphane;hydrate
CID 161337391
barium(2+);but-2-enoic acid;hydride
CID 173455030
but-2-enoic acid;formic acid
CID 53399155
but-2-enoic acid;N-methylmethanamine;hydrochloride
CID 173091669
4-oxohepta-2,5-dienoic acid
CID 54093333
(Z)-but-2-enoic acid;2-methylprop-2-enoic acid
CID 87787293
but-2-enoic acid;pentan-3-one
CID 173308572
1-aminoethanol;(E)-but-2-enoic acid
CID 87299473
but-2-enoic acid;tetracosane
CID 159276528
but-2-enoic acid;octane-1,8-diol
CID 175483633

Frequently Asked Questions

What is the IUPAC name of (Z)-but-2-enoic acid;yttrium?
The IUPAC name of (Z)-but-2-enoic acid;yttrium (CID 58782397) is (Z)-but-2-enoic acid;yttrium.
What is the SMILES notation for (Z)-but-2-enoic acid;yttrium?
The canonical SMILES for (Z)-but-2-enoic acid;yttrium is C/C=C\C(=O)O.[Y].
What is the InChIKey of (Z)-but-2-enoic acid;yttrium?
The InChIKey is IQAFYOQQPXIBCD-OLGQORCHSA-N. The full InChI is InChI=1S/C4H6O2.Y/c1-2-3-4(5)6;/h2-3H,1H3,(H,5,6);/b3-2-;.
What are the key properties of (Z)-but-2-enoic acid;yttrium?
(Z)-but-2-enoic acid;yttrium has a molecular weight of 175.00 g/mol, XLogP of 0.64, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-but-2-enoic acid;yttrium is sourced from PubChem (CID 58782397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).