dichloromethyl(methyl)phosphane

C2H5Cl2P — CID 141275660

IUPACdichloromethyl(methyl)phosphane
SMILESCPC(Cl)Cl
InChIInChI=1S/C2H5Cl2P/c1-5-2(3)4/h2,5H,1H3
InChIKeyOPEBTELFKZTHOJ-UHFFFAOYSA-N
MW130.94 g/mol
LogP2.06
Rot. Bonds1

About dichloromethyl(methyl)phosphane

dichloromethyl(methyl)phosphane (PubChem CID 141275660) has the molecular formula C2H5Cl2P and a molecular weight of 130.94 g/mol. Its IUPAC name is dichloromethyl(methyl)phosphane.

Molecular Properties

Compound Namedichloromethyl(methyl)phosphane
PubChem CID141275660
Molecular FormulaC2H5Cl2P
Molecular Weight130.94 g/mol
Exact Mass129.95
IUPAC Namedichloromethyl(methyl)phosphane
SMILESCPC(Cl)Cl
InChIInChI=1S/C2H5Cl2P/c1-5-2(3)4/h2,5H,1H3
InChIKeyOPEBTELFKZTHOJ-UHFFFAOYSA-N
XLogP2.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.94
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dichloromethyl(methyl)phosphane?
The IUPAC name of dichloromethyl(methyl)phosphane (CID 141275660) is dichloromethyl(methyl)phosphane.
What is the SMILES notation for dichloromethyl(methyl)phosphane?
The canonical SMILES for dichloromethyl(methyl)phosphane is CPC(Cl)Cl.
What is the InChIKey of dichloromethyl(methyl)phosphane?
The InChIKey is OPEBTELFKZTHOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5Cl2P/c1-5-2(3)4/h2,5H,1H3.
What are the key properties of dichloromethyl(methyl)phosphane?
dichloromethyl(methyl)phosphane has a molecular weight of 130.94 g/mol, XLogP of 2.06, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dichloromethyl(methyl)phosphane is sourced from PubChem (CID 141275660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).