CID 158968101

C2H3CrINaO2 — CID 158968101

IUPAC—
SMILESCC(=O)[O-].[Cr+2].[I-].[Na]
InChIInChI=1S/C2H4O2.Cr.HI.Na/c1-2(3)4;;;/h1H3,(H,3,4);;1H;/q;+2;;/p-2
InChIKeyJNLRYOOKHJBNPL-UHFFFAOYSA-L
MW260.93 g/mol
LogP-4.62
Rot. Bonds

About CID 158968101

CID 158968101 (PubChem CID 158968101) has the molecular formula C2H3CrINaO2 and a molecular weight of 260.93 g/mol.

Molecular Properties

Compound NameCID 158968101
PubChem CID158968101
Molecular FormulaC2H3CrINaO2
Molecular Weight260.93 g/mol
Exact Mass260.85
IUPAC Name—
SMILESCC(=O)[O-].[Cr+2].[I-].[Na]
InChIInChI=1S/C2H4O2.Cr.HI.Na/c1-2(3)4;;;/h1H3,(H,3,4);;1H;/q;+2;;/p-2
InChIKeyJNLRYOOKHJBNPL-UHFFFAOYSA-L
XLogP-4.62
TPSA40.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.93
LogP ≤ 5-4.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 158968101?
The IUPAC name of CID 158968101 (CID 158968101) is not available.
What is the SMILES notation for CID 158968101?
The canonical SMILES for CID 158968101 is CC(=O)[O-].[Cr+2].[I-].[Na].
What is the InChIKey of CID 158968101?
The InChIKey is JNLRYOOKHJBNPL-UHFFFAOYSA-L. The full InChI is InChI=1S/C2H4O2.Cr.HI.Na/c1-2(3)4;;;/h1H3,(H,3,4);;1H;/q;+2;;/p-2.
What are the key properties of CID 158968101?
CID 158968101 has a molecular weight of 260.93 g/mol, XLogP of -4.62, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 158968101 is sourced from PubChem (CID 158968101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).