chloro hypochlorite;chloromethane;phosphane

CH6Cl3OP — CID 157074558

IUPACchloro hypochlorite;chloromethane;phosphane
SMILESCCl.ClOCl.P
InChIInChI=1S/CH3Cl.Cl2O.H3P/c1-2;1-3-2;/h1H3;;1H3
InChIKeyHYFOEMRQIIUENT-UHFFFAOYSA-N
MW171.39 g/mol
LogP2.22
Rot. Bonds

About chloro hypochlorite;chloromethane;phosphane

chloro hypochlorite;chloromethane;phosphane (PubChem CID 157074558) has the molecular formula CH6Cl3OP and a molecular weight of 171.39 g/mol. Its IUPAC name is chloro hypochlorite;chloromethane;phosphane.

Molecular Properties

Compound Namechloro hypochlorite;chloromethane;phosphane
PubChem CID157074558
Molecular FormulaCH6Cl3OP
Molecular Weight171.39 g/mol
Exact Mass169.92
IUPAC Namechloro hypochlorite;chloromethane;phosphane
SMILESCCl.ClOCl.P
InChIInChI=1S/CH3Cl.Cl2O.H3P/c1-2;1-3-2;/h1H3;;1H3
InChIKeyHYFOEMRQIIUENT-UHFFFAOYSA-N
XLogP2.22
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.39
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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CID 86746833
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Frequently Asked Questions

What is the IUPAC name of chloro hypochlorite;chloromethane;phosphane?
The IUPAC name of chloro hypochlorite;chloromethane;phosphane (CID 157074558) is chloro hypochlorite;chloromethane;phosphane.
What is the SMILES notation for chloro hypochlorite;chloromethane;phosphane?
The canonical SMILES for chloro hypochlorite;chloromethane;phosphane is CCl.ClOCl.P.
What is the InChIKey of chloro hypochlorite;chloromethane;phosphane?
The InChIKey is HYFOEMRQIIUENT-UHFFFAOYSA-N. The full InChI is InChI=1S/CH3Cl.Cl2O.H3P/c1-2;1-3-2;/h1H3;;1H3.
What are the key properties of chloro hypochlorite;chloromethane;phosphane?
chloro hypochlorite;chloromethane;phosphane has a molecular weight of 171.39 g/mol, XLogP of 2.22, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for chloro hypochlorite;chloromethane;phosphane is sourced from PubChem (CID 157074558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).