dichloronickel;N,N-dimethylformamide

C3H7Cl2NNiO — CID 174793143

IUPACdichloronickel;N,N-dimethylformamide
SMILESCN(C)C=O.Cl[Ni]Cl
InChIInChI=1S/C3H7NO.2ClH.Ni/c1-4(2)3-5;;;/h3H,1-2H3;2*1H;/q;;;+2/p-2
InChIKeyMJUOJEAMSYVWBU-UHFFFAOYSA-L
MW202.69 g/mol
LogP1.08
Rot. Bonds1

About dichloronickel;N,N-dimethylformamide

dichloronickel;N,N-dimethylformamide (PubChem CID 174793143) has the molecular formula C3H7Cl2NNiO and a molecular weight of 202.69 g/mol. Its IUPAC name is dichloronickel;N,N-dimethylformamide.

Molecular Properties

Compound Namedichloronickel;N,N-dimethylformamide
PubChem CID174793143
Molecular FormulaC3H7Cl2NNiO
Molecular Weight202.69 g/mol
Exact Mass200.93
IUPAC Namedichloronickel;N,N-dimethylformamide
SMILESCN(C)C=O.Cl[Ni]Cl
InChIInChI=1S/C3H7NO.2ClH.Ni/c1-4(2)3-5;;;/h3H,1-2H3;2*1H;/q;;;+2/p-2
InChIKeyMJUOJEAMSYVWBU-UHFFFAOYSA-L
XLogP1.08
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.69
LogP ≤ 51.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dichloronickel;N,N-dimethylformamide?
The IUPAC name of dichloronickel;N,N-dimethylformamide (CID 174793143) is dichloronickel;N,N-dimethylformamide.
What is the SMILES notation for dichloronickel;N,N-dimethylformamide?
The canonical SMILES for dichloronickel;N,N-dimethylformamide is CN(C)C=O.Cl[Ni]Cl.
What is the InChIKey of dichloronickel;N,N-dimethylformamide?
The InChIKey is MJUOJEAMSYVWBU-UHFFFAOYSA-L. The full InChI is InChI=1S/C3H7NO.2ClH.Ni/c1-4(2)3-5;;;/h3H,1-2H3;2*1H;/q;;;+2/p-2.
What are the key properties of dichloronickel;N,N-dimethylformamide?
dichloronickel;N,N-dimethylformamide has a molecular weight of 202.69 g/mol, XLogP of 1.08, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dichloronickel;N,N-dimethylformamide is sourced from PubChem (CID 174793143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).