chloride dihydrochloride

H2Cl3- — CID 18003879

IUPACchloride dihydrochloride
SMILESCl.Cl.[Cl-]
InChIInChI=1S/3ClH/h3*1H/p-1
InChIKeyXEKAUTDWPYQNFU-UHFFFAOYSA-M
MW108.38 g/mol
LogP-2.15
Rot. Bonds

About chloride dihydrochloride

chloride dihydrochloride (PubChem CID 18003879) has the molecular formula H2Cl3- and a molecular weight of 108.38 g/mol. Its IUPAC name is chloride dihydrochloride.

Molecular Properties

Compound Namechloride dihydrochloride
PubChem CID18003879
Molecular FormulaH2Cl3-
Molecular Weight108.38 g/mol
Exact Mass106.92
IUPAC Namechloride dihydrochloride
SMILESCl.Cl.[Cl-]
InChIInChI=1S/3ClH/h3*1H/p-1
InChIKeyXEKAUTDWPYQNFU-UHFFFAOYSA-M
XLogP-2.15
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms3
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500108.38
LogP ≤ 5-2.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of chloride dihydrochloride?
The IUPAC name of chloride dihydrochloride (CID 18003879) is chloride dihydrochloride.
What is the SMILES notation for chloride dihydrochloride?
The canonical SMILES for chloride dihydrochloride is Cl.Cl.[Cl-].
What is the InChIKey of chloride dihydrochloride?
The InChIKey is XEKAUTDWPYQNFU-UHFFFAOYSA-M. The full InChI is InChI=1S/3ClH/h3*1H/p-1.
What are the key properties of chloride dihydrochloride?
chloride dihydrochloride has a molecular weight of 108.38 g/mol, XLogP of -2.15, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloride dihydrochloride is sourced from PubChem (CID 18003879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).