cobalt;bis(1,4-xylene)

C16H20Co — CID 67859603

IUPACcobalt;bis(1,4-xylene)
SMILESCc1ccc(C)cc1.Cc1ccc(C)cc1.[Co]
InChIInChI=1S/2C8H10.Co/c2*1-7-3-5-8(2)6-4-7;/h2*3-6H,1-2H3;
InChIKeyBFVNASQMDPPYNN-UHFFFAOYSA-N
MW271.27 g/mol
LogP4.60
Rot. Bonds

About cobalt;bis(1,4-xylene)

cobalt;bis(1,4-xylene) (PubChem CID 67859603) has the molecular formula C16H20Co and a molecular weight of 271.27 g/mol. Its IUPAC name is cobalt;bis(1,4-xylene).

Molecular Properties

Compound Namecobalt;bis(1,4-xylene)
PubChem CID67859603
Molecular FormulaC16H20Co
Molecular Weight271.27 g/mol
Exact Mass271.09
IUPAC Namecobalt;bis(1,4-xylene)
SMILESCc1ccc(C)cc1.Cc1ccc(C)cc1.[Co]
InChIInChI=1S/2C8H10.Co/c2*1-7-3-5-8(2)6-4-7;/h2*3-6H,1-2H3;
InChIKeyBFVNASQMDPPYNN-UHFFFAOYSA-N
XLogP4.60
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.27
LogP ≤ 54.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of cobalt;bis(1,4-xylene)?
The IUPAC name of cobalt;bis(1,4-xylene) (CID 67859603) is cobalt;bis(1,4-xylene).
What is the SMILES notation for cobalt;bis(1,4-xylene)?
The canonical SMILES for cobalt;bis(1,4-xylene) is Cc1ccc(C)cc1.Cc1ccc(C)cc1.[Co].
What is the InChIKey of cobalt;bis(1,4-xylene)?
The InChIKey is BFVNASQMDPPYNN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H10.Co/c2*1-7-3-5-8(2)6-4-7;/h2*3-6H,1-2H3;.
What are the key properties of cobalt;bis(1,4-xylene)?
cobalt;bis(1,4-xylene) has a molecular weight of 271.27 g/mol, XLogP of 4.60, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cobalt;bis(1,4-xylene) is sourced from PubChem (CID 67859603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).