CID 173175010

H2CaO8V2 — CID 173175010

IUPAC—
SMILESO=[V]=O.O=[V]=O.[Ca+2].[O-]O.[O-]O
InChIInChI=1S/Ca.2H2O2.4O.2V/c;2*1-2;;;;;;/h;2*1-2H;;;;;;/q+2;;;;;;;;/p-2
InChIKeyCMCUNXOIJUEGSW-UHFFFAOYSA-L
MW271.97 g/mol
LogP-3.22
Rot. Bonds

About CID 173175010

CID 173175010 (PubChem CID 173175010) has the molecular formula H2CaO8V2 and a molecular weight of 271.97 g/mol.

Molecular Properties

Compound NameCID 173175010
PubChem CID173175010
Molecular FormulaH2CaO8V2
Molecular Weight271.97 g/mol
Exact Mass271.83
IUPAC Name—
SMILESO=[V]=O.O=[V]=O.[Ca+2].[O-]O.[O-]O
InChIInChI=1S/Ca.2H2O2.4O.2V/c;2*1-2;;;;;;/h;2*1-2H;;;;;;/q+2;;;;;;;;/p-2
InChIKeyCMCUNXOIJUEGSW-UHFFFAOYSA-L
XLogP-3.22
TPSA154.86 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.97
LogP ≤ 5-3.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

Analyze CID 173175010 with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

sodium;dioxovanadium;fluoro(hydroxy)phosphinate
CID 174759223
Sodium dioxidan-1-ide
CID 23669912
CID 157388273
CID 157388273
calcium;ruthenium;carbonate
CID 87309849
chromium(6+);oxalate
CID 138397959
calcium;cobalt;carbonate
CID 87309011
calcium;carbonate;hydrate
CID 23282065
lithium vanadium dioxide
CID 154732519
triacontacalcium;carbonic acid;triacontacarbonate
CID 173108074
formaldehyde;molybdenum;tricarbonate
CID 19825551
dicalcium;oxalate;oxygen(2-)
CID 172811671
decacalcium;carbonic acid;decacarbonate
CID 173264131

Frequently Asked Questions

What is the IUPAC name of CID 173175010?
The IUPAC name of CID 173175010 (CID 173175010) is not available.
What is the SMILES notation for CID 173175010?
The canonical SMILES for CID 173175010 is O=[V]=O.O=[V]=O.[Ca+2].[O-]O.[O-]O.
What is the InChIKey of CID 173175010?
The InChIKey is CMCUNXOIJUEGSW-UHFFFAOYSA-L. The full InChI is InChI=1S/Ca.2H2O2.4O.2V/c;2*1-2;;;;;;/h;2*1-2H;;;;;;/q+2;;;;;;;;/p-2.
What are the key properties of CID 173175010?
CID 173175010 has a molecular weight of 271.97 g/mol, XLogP of -3.22, 0 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173175010 is sourced from PubChem (CID 173175010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).