CID 10892468

C10H16O4Sn — CID 10892468

IUPAC—
SMILESCC(=O)/C=C(/C)O.CC(=O)/C=C(/C)O.[Sn]
InChIInChI=1S/2C5H8O2.Sn/c2*1-4(6)3-5(2)7;/h2*3,6H,1-2H3;/b2*4-3-;
InChIKeyVEWCXNGKCXJURY-FDGPNNRMSA-N
MW318.95 g/mol
LogP1.69
Rot. Bonds2

About CID 10892468

CID 10892468 (PubChem CID 10892468) has the molecular formula C10H16O4Sn and a molecular weight of 318.95 g/mol.

Molecular Properties

Compound NameCID 10892468
PubChem CID10892468
Molecular FormulaC10H16O4Sn
Molecular Weight318.95 g/mol
Exact Mass320.01
IUPAC Name—
SMILESCC(=O)/C=C(/C)O.CC(=O)/C=C(/C)O.[Sn]
InChIInChI=1S/2C5H8O2.Sn/c2*1-4(6)3-5(2)7;/h2*3,6H,1-2H3;/b2*4-3-;
InChIKeyVEWCXNGKCXJURY-FDGPNNRMSA-N
XLogP1.69
TPSA74.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.95
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 10892468?
The IUPAC name of CID 10892468 (CID 10892468) is not available.
What is the SMILES notation for CID 10892468?
The canonical SMILES for CID 10892468 is CC(=O)/C=C(/C)O.CC(=O)/C=C(/C)O.[Sn].
What is the InChIKey of CID 10892468?
The InChIKey is VEWCXNGKCXJURY-FDGPNNRMSA-N. The full InChI is InChI=1S/2C5H8O2.Sn/c2*1-4(6)3-5(2)7;/h2*3,6H,1-2H3;/b2*4-3-;.
What are the key properties of CID 10892468?
CID 10892468 has a molecular weight of 318.95 g/mol, XLogP of 1.69, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 10892468 is sourced from PubChem (CID 10892468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).