CID 134991141

C10H10Cl2Ni — CID 134991141

IUPAC—
SMILESCl[Ni]Cl.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1
InChIInChI=1S/2C5H5.2ClH.Ni/c2*1-2-4-5-3-1;;;/h2*1-5H;2*1H;/q;;;;+2/p-2
InChIKeyXUJZEFITNWWXCE-UHFFFAOYSA-L
MW259.79 g/mol
LogP3.42
Rot. Bonds

About CID 134991141

CID 134991141 (PubChem CID 134991141) has the molecular formula C10H10Cl2Ni and a molecular weight of 259.79 g/mol.

Molecular Properties

Compound NameCID 134991141
PubChem CID134991141
Molecular FormulaC10H10Cl2Ni
Molecular Weight259.79 g/mol
Exact Mass257.95
IUPAC Name—
SMILESCl[Ni]Cl.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1
InChIInChI=1S/2C5H5.2ClH.Ni/c2*1-2-4-5-3-1;;;/h2*1-5H;2*1H;/q;;;;+2/p-2
InChIKeyXUJZEFITNWWXCE-UHFFFAOYSA-L
XLogP3.42
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.79
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of CID 134991141?
The IUPAC name of CID 134991141 (CID 134991141) is not available.
What is the SMILES notation for CID 134991141?
The canonical SMILES for CID 134991141 is Cl[Ni]Cl.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.
What is the InChIKey of CID 134991141?
The InChIKey is XUJZEFITNWWXCE-UHFFFAOYSA-L. The full InChI is InChI=1S/2C5H5.2ClH.Ni/c2*1-2-4-5-3-1;;;/h2*1-5H;2*1H;/q;;;;+2/p-2.
What are the key properties of CID 134991141?
CID 134991141 has a molecular weight of 259.79 g/mol, XLogP of 3.42, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 134991141 is sourced from PubChem (CID 134991141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).