1,1-dichloro-2-(2,2-difluorocyclopropyl)cyclopropane

C6H6Cl2F2 — CID 67880193

IUPAC1,1-dichloro-2-(2,2-difluorocyclopropyl)cyclopropane
SMILESFC1(F)CC1C1CC1(Cl)Cl
InChIInChI=1S/C6H6Cl2F2/c7-5(8)1-3(5)4-2-6(4,9)10/h3-4H,1-2H2
InChIKeyICRCDKQCBHDTSJ-UHFFFAOYSA-N
MW187.02 g/mol
LogP2.84
Rot. Bonds1

About 1,1-dichloro-2-(2,2-difluorocyclopropyl)cyclopropane

1,1-dichloro-2-(2,2-difluorocyclopropyl)cyclopropane (PubChem CID 67880193) has the molecular formula C6H6Cl2F2 and a molecular weight of 187.02 g/mol. Its IUPAC name is 1,1-dichloro-2-(2,2-difluorocyclopropyl)cyclopropane.

Molecular Properties

Compound Name1,1-dichloro-2-(2,2-difluorocyclopropyl)cyclopropane
PubChem CID67880193
Molecular FormulaC6H6Cl2F2
Molecular Weight187.02 g/mol
Exact Mass185.98
IUPAC Name1,1-dichloro-2-(2,2-difluorocyclopropyl)cyclopropane
SMILESFC1(F)CC1C1CC1(Cl)Cl
InChIInChI=1S/C6H6Cl2F2/c7-5(8)1-3(5)4-2-6(4,9)10/h3-4H,1-2H2
InChIKeyICRCDKQCBHDTSJ-UHFFFAOYSA-N
XLogP2.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.02
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,1-dichloro-2-(2,2-difluorocyclopropyl)cyclopropane?
The IUPAC name of 1,1-dichloro-2-(2,2-difluorocyclopropyl)cyclopropane (CID 67880193) is 1,1-dichloro-2-(2,2-difluorocyclopropyl)cyclopropane.
What is the SMILES notation for 1,1-dichloro-2-(2,2-difluorocyclopropyl)cyclopropane?
The canonical SMILES for 1,1-dichloro-2-(2,2-difluorocyclopropyl)cyclopropane is FC1(F)CC1C1CC1(Cl)Cl.
What is the InChIKey of 1,1-dichloro-2-(2,2-difluorocyclopropyl)cyclopropane?
The InChIKey is ICRCDKQCBHDTSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6Cl2F2/c7-5(8)1-3(5)4-2-6(4,9)10/h3-4H,1-2H2.
What are the key properties of 1,1-dichloro-2-(2,2-difluorocyclopropyl)cyclopropane?
1,1-dichloro-2-(2,2-difluorocyclopropyl)cyclopropane has a molecular weight of 187.02 g/mol, XLogP of 2.84, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dichloro-2-(2,2-difluorocyclopropyl)cyclopropane is sourced from PubChem (CID 67880193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).