CID 87524640

C2H6KO2 — CID 87524640

IUPAC—
SMILESOCCO.[K]
InChIInChI=1S/C2H6O2.K/c3-1-2-4;/h3-4H,1-2H2;
InChIKeyZSXFZANQMJQBTQ-UHFFFAOYSA-N
MW101.17 g/mol
LogP-1.41
Rot. Bonds1

About CID 87524640

CID 87524640 (PubChem CID 87524640) has the molecular formula C2H6KO2 and a molecular weight of 101.17 g/mol.

Molecular Properties

Compound NameCID 87524640
PubChem CID87524640
Molecular FormulaC2H6KO2
Molecular Weight101.17 g/mol
Exact Mass101.00
IUPAC Name—
SMILESOCCO.[K]
InChIInChI=1S/C2H6O2.K/c3-1-2-4;/h3-4H,1-2H2;
InChIKeyZSXFZANQMJQBTQ-UHFFFAOYSA-N
XLogP-1.41
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.17
LogP ≤ 5-1.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 87524640?
The IUPAC name of CID 87524640 (CID 87524640) is not available.
What is the SMILES notation for CID 87524640?
The canonical SMILES for CID 87524640 is OCCO.[K].
What is the InChIKey of CID 87524640?
The InChIKey is ZSXFZANQMJQBTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6O2.K/c3-1-2-4;/h3-4H,1-2H2;.
What are the key properties of CID 87524640?
CID 87524640 has a molecular weight of 101.17 g/mol, XLogP of -1.41, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 87524640 is sourced from PubChem (CID 87524640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).