dichloro-(fluoromethyl)-sulfanylidene-λ5-phosphane

CH2Cl2FPS — CID 13426208

IUPACdichloro-(fluoromethyl)-sulfanylidene-λ5-phosphane
SMILESFCP(=S)(Cl)Cl
InChIInChI=1S/CH2Cl2FPS/c2-5(3,6)1-4/h1H2
InChIKeyVPNFMUHGLBVPSV-UHFFFAOYSA-N
MW166.97 g/mol
LogP2.70
Rot. Bonds1

About dichloro-(fluoromethyl)-sulfanylidene-λ5-phosphane

dichloro-(fluoromethyl)-sulfanylidene-λ5-phosphane (PubChem CID 13426208) has the molecular formula CH2Cl2FPS and a molecular weight of 166.97 g/mol. Its IUPAC name is dichloro-(fluoromethyl)-sulfanylidene-λ5-phosphane.

Molecular Properties

Compound Namedichloro-(fluoromethyl)-sulfanylidene-λ5-phosphane
PubChem CID13426208
Molecular FormulaCH2Cl2FPS
Molecular Weight166.97 g/mol
Exact Mass165.90
IUPAC Namedichloro-(fluoromethyl)-sulfanylidene-λ5-phosphane
SMILESFCP(=S)(Cl)Cl
InChIInChI=1S/CH2Cl2FPS/c2-5(3,6)1-4/h1H2
InChIKeyVPNFMUHGLBVPSV-UHFFFAOYSA-N
XLogP2.70
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.97
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dichloro-(fluoromethyl)-sulfanylidene-λ5-phosphane?
The IUPAC name of dichloro-(fluoromethyl)-sulfanylidene-λ5-phosphane (CID 13426208) is dichloro-(fluoromethyl)-sulfanylidene-λ5-phosphane.
What is the SMILES notation for dichloro-(fluoromethyl)-sulfanylidene-λ5-phosphane?
The canonical SMILES for dichloro-(fluoromethyl)-sulfanylidene-λ5-phosphane is FCP(=S)(Cl)Cl.
What is the InChIKey of dichloro-(fluoromethyl)-sulfanylidene-λ5-phosphane?
The InChIKey is VPNFMUHGLBVPSV-UHFFFAOYSA-N. The full InChI is InChI=1S/CH2Cl2FPS/c2-5(3,6)1-4/h1H2.
What are the key properties of dichloro-(fluoromethyl)-sulfanylidene-λ5-phosphane?
dichloro-(fluoromethyl)-sulfanylidene-λ5-phosphane has a molecular weight of 166.97 g/mol, XLogP of 2.70, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro-(fluoromethyl)-sulfanylidene-λ5-phosphane is sourced from PubChem (CID 13426208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).