CID 135047011

C4CrNa4O4 — CID 135047011

IUPAC—
SMILES[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Cr].[Na].[Na].[Na].[Na]
InChIInChI=1S/4CO.Cr.4Na/c4*1-2;;;;;
InChIKeyIHTPCBXRWZOOFM-UHFFFAOYSA-N
MW256.00 g/mol
LogP-1.68
Rot. Bonds

About CID 135047011

CID 135047011 (PubChem CID 135047011) has the molecular formula C4CrNa4O4 and a molecular weight of 256.00 g/mol.

Molecular Properties

Compound NameCID 135047011
PubChem CID135047011
Molecular FormulaC4CrNa4O4
Molecular Weight256.00 g/mol
Exact Mass255.88
IUPAC Name—
SMILES[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Cr].[Na].[Na].[Na].[Na]
InChIInChI=1S/4CO.Cr.4Na/c4*1-2;;;;;
InChIKeyIHTPCBXRWZOOFM-UHFFFAOYSA-N
XLogP-1.68
TPSA79.60 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.00
LogP ≤ 5-1.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'charged_oxygen_or_sulfur_atoms', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 135047011?
The IUPAC name of CID 135047011 (CID 135047011) is not available.
What is the SMILES notation for CID 135047011?
The canonical SMILES for CID 135047011 is [C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Cr].[Na].[Na].[Na].[Na].
What is the InChIKey of CID 135047011?
The InChIKey is IHTPCBXRWZOOFM-UHFFFAOYSA-N. The full InChI is InChI=1S/4CO.Cr.4Na/c4*1-2;;;;;.
What are the key properties of CID 135047011?
CID 135047011 has a molecular weight of 256.00 g/mol, XLogP of -1.68, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 135047011 is sourced from PubChem (CID 135047011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).