carbonic acid;cobalt;2-methylcyclopenta-1,3-diene

C8H11CoO6- — CID 175530723

IUPACcarbonic acid;cobalt;2-methylcyclopenta-1,3-diene
SMILESCC1=[C-]CC=C1.O=C(O)O.O=C(O)O.[Co]
InChIInChI=1S/C6H7.2CH2O3.Co/c1-6-4-2-3-5-6;2*2-1(3)4;/h2,4H,3H2,1H3;2*(H2,2,3,4);/q-1;;;
InChIKeyOSJVRGBKFXMYER-UHFFFAOYSA-N
MW262.10 g/mol
LogP2.14
Rot. Bonds

About carbonic acid;cobalt;2-methylcyclopenta-1,3-diene

carbonic acid;cobalt;2-methylcyclopenta-1,3-diene (PubChem CID 175530723) has the molecular formula C8H11CoO6- and a molecular weight of 262.10 g/mol. Its IUPAC name is carbonic acid;cobalt;2-methylcyclopenta-1,3-diene.

Molecular Properties

Compound Namecarbonic acid;cobalt;2-methylcyclopenta-1,3-diene
PubChem CID175530723
Molecular FormulaC8H11CoO6-
Molecular Weight262.10 g/mol
Exact Mass261.99
IUPAC Namecarbonic acid;cobalt;2-methylcyclopenta-1,3-diene
SMILESCC1=[C-]CC=C1.O=C(O)O.O=C(O)O.[Co]
InChIInChI=1S/C6H7.2CH2O3.Co/c1-6-4-2-3-5-6;2*2-1(3)4;/h2,4H,3H2,1H3;2*(H2,2,3,4);/q-1;;;
InChIKeyOSJVRGBKFXMYER-UHFFFAOYSA-N
XLogP2.14
TPSA115.06 Ų
H-Bond Donors4
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.10
LogP ≤ 52.14
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of carbonic acid;cobalt;2-methylcyclopenta-1,3-diene?
The IUPAC name of carbonic acid;cobalt;2-methylcyclopenta-1,3-diene (CID 175530723) is carbonic acid;cobalt;2-methylcyclopenta-1,3-diene.
What is the SMILES notation for carbonic acid;cobalt;2-methylcyclopenta-1,3-diene?
The canonical SMILES for carbonic acid;cobalt;2-methylcyclopenta-1,3-diene is CC1=[C-]CC=C1.O=C(O)O.O=C(O)O.[Co].
What is the InChIKey of carbonic acid;cobalt;2-methylcyclopenta-1,3-diene?
The InChIKey is OSJVRGBKFXMYER-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7.2CH2O3.Co/c1-6-4-2-3-5-6;2*2-1(3)4;/h2,4H,3H2,1H3;2*(H2,2,3,4);/q-1;;;.
What are the key properties of carbonic acid;cobalt;2-methylcyclopenta-1,3-diene?
carbonic acid;cobalt;2-methylcyclopenta-1,3-diene has a molecular weight of 262.10 g/mol, XLogP of 2.14, 0 rotatable bonds, 4 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for carbonic acid;cobalt;2-methylcyclopenta-1,3-diene is sourced from PubChem (CID 175530723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).