chlorophosphane;1,2-dichloroethane

C2H6Cl3P — CID 174800831

IUPACchlorophosphane;1,2-dichloroethane
SMILESClCCCl.PCl
InChIInChI=1S/C2H4Cl2.ClH2P/c3-1-2-4;1-2/h1-2H2;2H2
InChIKeyCBAXLRMSUDBQGI-UHFFFAOYSA-N
MW167.40 g/mol
LogP2.48
Rot. Bonds1

About chlorophosphane;1,2-dichloroethane

chlorophosphane;1,2-dichloroethane (PubChem CID 174800831) has the molecular formula C2H6Cl3P and a molecular weight of 167.40 g/mol. Its IUPAC name is chlorophosphane;1,2-dichloroethane.

Molecular Properties

Compound Namechlorophosphane;1,2-dichloroethane
PubChem CID174800831
Molecular FormulaC2H6Cl3P
Molecular Weight167.40 g/mol
Exact Mass165.93
IUPAC Namechlorophosphane;1,2-dichloroethane
SMILESClCCCl.PCl
InChIInChI=1S/C2H4Cl2.ClH2P/c3-1-2-4;1-2/h1-2H2;2H2
InChIKeyCBAXLRMSUDBQGI-UHFFFAOYSA-N
XLogP2.48
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.40
LogP ≤ 52.48
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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Related Compounds

1,2-dichloroethane;platinum
CID 159627340
(1,2-dichloroethane);(dichloromethane)
CID 173324905
magnesium;1,2-dichloroethane;hydride
CID 173326143
bis(1,1-dichloroethane);bis(1,2-dichloroethane)
CID 175329145
1,2-dibromoethane;1,2-dichloroethane;tetrachloromethane
CID 3041329
acetyl chloride;1,2-dichloroethane
CID 159411616
2-chloroethyl-λ2-stannane
CID 174385279
6-chlorohexylphosphane
CID 150562107
1,2-dichloroethane;furan
CID 21219342
dichloromethane;germane
CID 174557663
CID 87274674
CID 87274674
dichloromethane;proton
CID 174889445

Frequently Asked Questions

What is the IUPAC name of chlorophosphane;1,2-dichloroethane?
The IUPAC name of chlorophosphane;1,2-dichloroethane (CID 174800831) is chlorophosphane;1,2-dichloroethane.
What is the SMILES notation for chlorophosphane;1,2-dichloroethane?
The canonical SMILES for chlorophosphane;1,2-dichloroethane is ClCCCl.PCl.
What is the InChIKey of chlorophosphane;1,2-dichloroethane?
The InChIKey is CBAXLRMSUDBQGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4Cl2.ClH2P/c3-1-2-4;1-2/h1-2H2;2H2.
What are the key properties of chlorophosphane;1,2-dichloroethane?
chlorophosphane;1,2-dichloroethane has a molecular weight of 167.40 g/mol, XLogP of 2.48, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chlorophosphane;1,2-dichloroethane is sourced from PubChem (CID 174800831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).