1,1-dichlorocyclopentane;dihydrochloride

C5H10Cl4 — CID 146484844

IUPAC1,1-dichlorocyclopentane;dihydrochloride
SMILESCl.Cl.ClC1(Cl)CCCC1
InChIInChI=1S/C5H8Cl2.2ClH/c6-5(7)3-1-2-4-5;;/h1-4H2;2*1H
InChIKeyJAYURGKBOCTQNA-UHFFFAOYSA-N
MW211.95 g/mol
LogP3.58
Rot. Bonds

About 1,1-dichlorocyclopentane;dihydrochloride

1,1-dichlorocyclopentane;dihydrochloride (PubChem CID 146484844) has the molecular formula C5H10Cl4 and a molecular weight of 211.95 g/mol. Its IUPAC name is 1,1-dichlorocyclopentane;dihydrochloride.

Molecular Properties

Compound Name1,1-dichlorocyclopentane;dihydrochloride
PubChem CID146484844
Molecular FormulaC5H10Cl4
Molecular Weight211.95 g/mol
Exact Mass209.95
IUPAC Name1,1-dichlorocyclopentane;dihydrochloride
SMILESCl.Cl.ClC1(Cl)CCCC1
InChIInChI=1S/C5H8Cl2.2ClH/c6-5(7)3-1-2-4-5;;/h1-4H2;2*1H
InChIKeyJAYURGKBOCTQNA-UHFFFAOYSA-N
XLogP3.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.95
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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CID 175162377
1,1-dichlorocyclooctane
CID 13066177
1,1-dichlorocyclobutane;hydrofluoride
CID 174902728
spiro[4.4]nonane;dihydrochloride
CID 172764572
1-chloro-1-methylcyclotridecane
CID 71082065
1,1,2,2,3,3,4,4,5,5-decachlorocyclodecane
CID 71370874
2,2,5,5-tetrachlorodispiro[2.0.24.63]dodecane
CID 13412659
spiro[2.6]nonane;hydrochloride
CID 141316852
spiro[4.4]nonane
CID 90780660
1-chloro-1-nitrosocyclododecane
CID 12551889
1-chloro-1-nitrosocyclopentadecane
CID 71360750
1-chloro-1,5,5-trimethylcyclotridecane
CID 71162180

Frequently Asked Questions

What is the IUPAC name of 1,1-dichlorocyclopentane;dihydrochloride?
The IUPAC name of 1,1-dichlorocyclopentane;dihydrochloride (CID 146484844) is 1,1-dichlorocyclopentane;dihydrochloride.
What is the SMILES notation for 1,1-dichlorocyclopentane;dihydrochloride?
The canonical SMILES for 1,1-dichlorocyclopentane;dihydrochloride is Cl.Cl.ClC1(Cl)CCCC1.
What is the InChIKey of 1,1-dichlorocyclopentane;dihydrochloride?
The InChIKey is JAYURGKBOCTQNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8Cl2.2ClH/c6-5(7)3-1-2-4-5;;/h1-4H2;2*1H.
What are the key properties of 1,1-dichlorocyclopentane;dihydrochloride?
1,1-dichlorocyclopentane;dihydrochloride has a molecular weight of 211.95 g/mol, XLogP of 3.58, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dichlorocyclopentane;dihydrochloride is sourced from PubChem (CID 146484844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).