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Perchlorohexane

HCID 55063
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Basic information

CAS
83682-34-2
Standard SMILES
ClC(Cl)(Cl)C(Cl)(Cl)C(Cl)(Cl)C(Cl)(Cl)C(Cl)(Cl)C(Cl)(Cl)Cl
InChIKey
JYRMMYKXEQLXNF-UHFFFAOYSA-N
Molecular formula
C6Cl14
Average molar mass
568.4 g/mol
Monoisotopic mass
561.563938

Names & identifiers

Preferred name
Perchlorohexane
IUPAC
1,1,1,2,2,3,3,4,4,5,5,6,6,6-tetradecachlorohexane

Names & synonyms

PERCHLOROHEXANE83682-34-2tetradecachlorohexaneSCHEMBL6693744DTXSID80232509

Database identifiers

CAS
83682-34-2
PubChem CID
55063
DTXSID
DTXSID80232509
Nikkaji
J1.596.102C

Properties

Computed structural properties

XLogP
8.6
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
3
Heavy atoms
20
Formal charge
0
Complexity
319

Related reactions

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Compound notes

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