carbonic acid;tantalum;hydrate;hydrochloride

C4H11ClO13Ta — CID 174435305

IUPACcarbonic acid;tantalum;hydrate;hydrochloride
SMILESCl.O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.[Ta]
InChIInChI=1S/4CH2O3.ClH.H2O.Ta/c4*2-1(3)4;;;/h4*(H2,2,3,4);1H;1H2;
InChIKeyLERQBVHZULGZKI-UHFFFAOYSA-N
MW483.52 g/mol
LogP0.48
Rot. Bonds

About carbonic acid;tantalum;hydrate;hydrochloride

carbonic acid;tantalum;hydrate;hydrochloride (PubChem CID 174435305) has the molecular formula C4H11ClO13Ta and a molecular weight of 483.52 g/mol. Its IUPAC name is carbonic acid;tantalum;hydrate;hydrochloride.

Molecular Properties

Compound Namecarbonic acid;tantalum;hydrate;hydrochloride
PubChem CID174435305
Molecular FormulaC4H11ClO13Ta
Molecular Weight483.52 g/mol
Exact Mass482.94
IUPAC Namecarbonic acid;tantalum;hydrate;hydrochloride
SMILESCl.O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.[Ta]
InChIInChI=1S/4CH2O3.ClH.H2O.Ta/c4*2-1(3)4;;;/h4*(H2,2,3,4);1H;1H2;
InChIKeyLERQBVHZULGZKI-UHFFFAOYSA-N
XLogP0.48
TPSA261.62 Ų
H-Bond Donors8
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500483.52
LogP ≤ 50.48
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of carbonic acid;tantalum;hydrate;hydrochloride?
The IUPAC name of carbonic acid;tantalum;hydrate;hydrochloride (CID 174435305) is carbonic acid;tantalum;hydrate;hydrochloride.
What is the SMILES notation for carbonic acid;tantalum;hydrate;hydrochloride?
The canonical SMILES for carbonic acid;tantalum;hydrate;hydrochloride is Cl.O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.[Ta].
What is the InChIKey of carbonic acid;tantalum;hydrate;hydrochloride?
The InChIKey is LERQBVHZULGZKI-UHFFFAOYSA-N. The full InChI is InChI=1S/4CH2O3.ClH.H2O.Ta/c4*2-1(3)4;;;/h4*(H2,2,3,4);1H;1H2;.
What are the key properties of carbonic acid;tantalum;hydrate;hydrochloride?
carbonic acid;tantalum;hydrate;hydrochloride has a molecular weight of 483.52 g/mol, XLogP of 0.48, 0 rotatable bonds, 8 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for carbonic acid;tantalum;hydrate;hydrochloride is sourced from PubChem (CID 174435305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).