molecular chlorine;heptahydrate

H14Cl2O7 — CID 140520049

IUPACmolecular chlorine;heptahydrate
SMILESClCl.O.O.O.O.O.O.O
InChIInChI=1S/Cl2.7H2O/c1-2;;;;;;;/h;7*1H2
InChIKeyXXBNAZMTJLUSOP-UHFFFAOYSA-N
MW197.01 g/mol
LogP-4.39
Rot. Bonds

About molecular chlorine;heptahydrate

molecular chlorine;heptahydrate (PubChem CID 140520049) has the molecular formula H14Cl2O7 and a molecular weight of 197.01 g/mol. Its IUPAC name is molecular chlorine;heptahydrate.

Molecular Properties

Compound Namemolecular chlorine;heptahydrate
PubChem CID140520049
Molecular FormulaH14Cl2O7
Molecular Weight197.01 g/mol
Exact Mass196.01
IUPAC Namemolecular chlorine;heptahydrate
SMILESClCl.O.O.O.O.O.O.O
InChIInChI=1S/Cl2.7H2O/c1-2;;;;;;;/h;7*1H2
InChIKeyXXBNAZMTJLUSOP-UHFFFAOYSA-N
XLogP-4.39
TPSA220.50 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.01
LogP ≤ 5-4.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of molecular chlorine;heptahydrate?
The IUPAC name of molecular chlorine;heptahydrate (CID 140520049) is molecular chlorine;heptahydrate.
What is the SMILES notation for molecular chlorine;heptahydrate?
The canonical SMILES for molecular chlorine;heptahydrate is ClCl.O.O.O.O.O.O.O.
What is the InChIKey of molecular chlorine;heptahydrate?
The InChIKey is XXBNAZMTJLUSOP-UHFFFAOYSA-N. The full InChI is InChI=1S/Cl2.7H2O/c1-2;;;;;;;/h;7*1H2.
What are the key properties of molecular chlorine;heptahydrate?
molecular chlorine;heptahydrate has a molecular weight of 197.01 g/mol, XLogP of -4.39, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for molecular chlorine;heptahydrate is sourced from PubChem (CID 140520049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).