dichlorotitanium;1,2-dimethylcyclopentane

C7H14Cl2Ti — CID 174468926

IUPACdichlorotitanium;1,2-dimethylcyclopentane
SMILESCC1CCCC1C.Cl[Ti]Cl
InChIInChI=1S/C7H14.2ClH.Ti/c1-6-4-3-5-7(6)2;;;/h6-7H,3-5H2,1-2H3;2*1H;/q;;;+2/p-2
InChIKeyYGVNURFKGCCGCR-UHFFFAOYSA-L
MW216.96 g/mol
LogP3.82
Rot. Bonds

About dichlorotitanium;1,2-dimethylcyclopentane

dichlorotitanium;1,2-dimethylcyclopentane (PubChem CID 174468926) has the molecular formula C7H14Cl2Ti and a molecular weight of 216.96 g/mol. Its IUPAC name is dichlorotitanium;1,2-dimethylcyclopentane.

Molecular Properties

Compound Namedichlorotitanium;1,2-dimethylcyclopentane
PubChem CID174468926
Molecular FormulaC7H14Cl2Ti
Molecular Weight216.96 g/mol
Exact Mass216.00
IUPAC Namedichlorotitanium;1,2-dimethylcyclopentane
SMILESCC1CCCC1C.Cl[Ti]Cl
InChIInChI=1S/C7H14.2ClH.Ti/c1-6-4-3-5-7(6)2;;;/h6-7H,3-5H2,1-2H3;2*1H;/q;;;+2/p-2
InChIKeyYGVNURFKGCCGCR-UHFFFAOYSA-L
XLogP3.82
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.96
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of dichlorotitanium;1,2-dimethylcyclopentane?
The IUPAC name of dichlorotitanium;1,2-dimethylcyclopentane (CID 174468926) is dichlorotitanium;1,2-dimethylcyclopentane.
What is the SMILES notation for dichlorotitanium;1,2-dimethylcyclopentane?
The canonical SMILES for dichlorotitanium;1,2-dimethylcyclopentane is CC1CCCC1C.Cl[Ti]Cl.
What is the InChIKey of dichlorotitanium;1,2-dimethylcyclopentane?
The InChIKey is YGVNURFKGCCGCR-UHFFFAOYSA-L. The full InChI is InChI=1S/C7H14.2ClH.Ti/c1-6-4-3-5-7(6)2;;;/h6-7H,3-5H2,1-2H3;2*1H;/q;;;+2/p-2.
What are the key properties of dichlorotitanium;1,2-dimethylcyclopentane?
dichlorotitanium;1,2-dimethylcyclopentane has a molecular weight of 216.96 g/mol, XLogP of 3.82, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dichlorotitanium;1,2-dimethylcyclopentane is sourced from PubChem (CID 174468926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).