CID 158983080

H2CsO3 — CID 158983080

IUPAC—
SMILESOOO.[Cs]
InChIInChI=1S/Cs.H2O3/c;1-3-2/h;1-2H
InChIKeyJPFYJDMWSPAKCM-UHFFFAOYSA-N
MW182.92 g/mol
LogP-0.43
Rot. Bonds

About CID 158983080

CID 158983080 (PubChem CID 158983080) has the molecular formula H2CsO3 and a molecular weight of 182.92 g/mol.

Molecular Properties

Compound NameCID 158983080
PubChem CID158983080
Molecular FormulaH2CsO3
Molecular Weight182.92 g/mol
Exact Mass182.91
IUPAC Name—
SMILESOOO.[Cs]
InChIInChI=1S/Cs.H2O3/c;1-3-2/h;1-2H
InChIKeyJPFYJDMWSPAKCM-UHFFFAOYSA-N
XLogP-0.43
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.92
LogP ≤ 5-0.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 158983080?
The IUPAC name of CID 158983080 (CID 158983080) is not available.
What is the SMILES notation for CID 158983080?
The canonical SMILES for CID 158983080 is OOO.[Cs].
What is the InChIKey of CID 158983080?
The InChIKey is JPFYJDMWSPAKCM-UHFFFAOYSA-N. The full InChI is InChI=1S/Cs.H2O3/c;1-3-2/h;1-2H.
What are the key properties of CID 158983080?
CID 158983080 has a molecular weight of 182.92 g/mol, XLogP of -0.43, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 158983080 is sourced from PubChem (CID 158983080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).