2-[(Z)-2,3-dichloro-3,3-difluoroprop-1-enyl]-1,1-dimethylcyclopropane

C8H10Cl2F2 — CID 173412089

IUPAC2-[(Z)-2,3-dichloro-3,3-difluoroprop-1-enyl]-1,1-dimethylcyclopropane
SMILESCC1(C)CC1/C=C(\Cl)C(F)(F)Cl
InChIInChI=1S/C8H10Cl2F2/c1-7(2)4-5(7)3-6(9)8(10,11)12/h3,5H,4H2,1-2H3/b6-3-
InChIKeyYYKZCSICDOXFRV-UTCJRWHESA-N
MW215.07 g/mol
LogP3.99
Rot. Bonds2

About 2-[(Z)-2,3-dichloro-3,3-difluoroprop-1-enyl]-1,1-dimethylcyclopropane

2-[(Z)-2,3-dichloro-3,3-difluoroprop-1-enyl]-1,1-dimethylcyclopropane (PubChem CID 173412089) has the molecular formula C8H10Cl2F2 and a molecular weight of 215.07 g/mol. Its IUPAC name is 2-[(Z)-2,3-dichloro-3,3-difluoroprop-1-enyl]-1,1-dimethylcyclopropane.

Molecular Properties

Compound Name2-[(Z)-2,3-dichloro-3,3-difluoroprop-1-enyl]-1,1-dimethylcyclopropane
PubChem CID173412089
Molecular FormulaC8H10Cl2F2
Molecular Weight215.07 g/mol
Exact Mass214.01
IUPAC Name2-[(Z)-2,3-dichloro-3,3-difluoroprop-1-enyl]-1,1-dimethylcyclopropane
SMILESCC1(C)CC1/C=C(\Cl)C(F)(F)Cl
InChIInChI=1S/C8H10Cl2F2/c1-7(2)4-5(7)3-6(9)8(10,11)12/h3,5H,4H2,1-2H3/b6-3-
InChIKeyYYKZCSICDOXFRV-UTCJRWHESA-N
XLogP3.99
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.07
LogP ≤ 53.99
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 2-[(Z)-2,3-dichloro-3,3-difluoroprop-1-enyl]-1,1-dimethylcyclopropane?
The IUPAC name of 2-[(Z)-2,3-dichloro-3,3-difluoroprop-1-enyl]-1,1-dimethylcyclopropane (CID 173412089) is 2-[(Z)-2,3-dichloro-3,3-difluoroprop-1-enyl]-1,1-dimethylcyclopropane.
What is the SMILES notation for 2-[(Z)-2,3-dichloro-3,3-difluoroprop-1-enyl]-1,1-dimethylcyclopropane?
The canonical SMILES for 2-[(Z)-2,3-dichloro-3,3-difluoroprop-1-enyl]-1,1-dimethylcyclopropane is CC1(C)CC1/C=C(\Cl)C(F)(F)Cl.
What is the InChIKey of 2-[(Z)-2,3-dichloro-3,3-difluoroprop-1-enyl]-1,1-dimethylcyclopropane?
The InChIKey is YYKZCSICDOXFRV-UTCJRWHESA-N. The full InChI is InChI=1S/C8H10Cl2F2/c1-7(2)4-5(7)3-6(9)8(10,11)12/h3,5H,4H2,1-2H3/b6-3-.
What are the key properties of 2-[(Z)-2,3-dichloro-3,3-difluoroprop-1-enyl]-1,1-dimethylcyclopropane?
2-[(Z)-2,3-dichloro-3,3-difluoroprop-1-enyl]-1,1-dimethylcyclopropane has a molecular weight of 215.07 g/mol, XLogP of 3.99, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-2,3-dichloro-3,3-difluoroprop-1-enyl]-1,1-dimethylcyclopropane is sourced from PubChem (CID 173412089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).