chloro hypochlorite;dichloromethane

CH2Cl4O — CID 163675978

IUPACchloro hypochlorite;dichloromethane
SMILESClCCl.ClOCl
InChIInChI=1S/CH2Cl2.Cl2O/c2-1-3;1-3-2/h1H2;
InChIKeyJGSSGAYDKPCJKG-UHFFFAOYSA-N
MW171.84 g/mol
LogP2.73
Rot. Bonds

About chloro hypochlorite;dichloromethane

chloro hypochlorite;dichloromethane (PubChem CID 163675978) has the molecular formula CH2Cl4O and a molecular weight of 171.84 g/mol. Its IUPAC name is chloro hypochlorite;dichloromethane.

Molecular Properties

Compound Namechloro hypochlorite;dichloromethane
PubChem CID163675978
Molecular FormulaCH2Cl4O
Molecular Weight171.84 g/mol
Exact Mass169.89
IUPAC Namechloro hypochlorite;dichloromethane
SMILESClCCl.ClOCl
InChIInChI=1S/CH2Cl2.Cl2O/c2-1-3;1-3-2/h1H2;
InChIKeyJGSSGAYDKPCJKG-UHFFFAOYSA-N
XLogP2.73
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.84
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

chloro hypochlorite;terbium
CID 161048693
CID 87274674
CID 87274674
dichloromethane;proton
CID 174889445
chloro hypochlorite;dysprosium
CID 158460662
chloro hypochlorite;zirconium
CID 174552405
dichloromethane;germane
CID 174557663
chloro hypochlorite;chromium
CID 161088594
chloro hypochlorite;osmium
CID 158480577
chloro hypochlorite;vanadium
CID 86746833
chloro hypochlorite;selane
CID 170842422
chloro hypochlorite;manganese
CID 160566723
azane;chloro hypochlorite
CID 157275998

Frequently Asked Questions

What is the IUPAC name of chloro hypochlorite;dichloromethane?
The IUPAC name of chloro hypochlorite;dichloromethane (CID 163675978) is chloro hypochlorite;dichloromethane.
What is the SMILES notation for chloro hypochlorite;dichloromethane?
The canonical SMILES for chloro hypochlorite;dichloromethane is ClCCl.ClOCl.
What is the InChIKey of chloro hypochlorite;dichloromethane?
The InChIKey is JGSSGAYDKPCJKG-UHFFFAOYSA-N. The full InChI is InChI=1S/CH2Cl2.Cl2O/c2-1-3;1-3-2/h1H2;.
What are the key properties of chloro hypochlorite;dichloromethane?
chloro hypochlorite;dichloromethane has a molecular weight of 171.84 g/mol, XLogP of 2.73, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for chloro hypochlorite;dichloromethane is sourced from PubChem (CID 163675978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).