2-(2,2-dichloroethenyl)-3-[(E)-2-methoxyethenyl]-1,1-dimethylcyclopropane

C10H14Cl2O — CID 23451683

IUPAC2-(2,2-dichloroethenyl)-3-[(E)-2-methoxyethenyl]-1,1-dimethylcyclopropane
SMILESCO/C=C/C1C(C=C(Cl)Cl)C1(C)C
InChIInChI=1S/C10H14Cl2O/c1-10(2)7(4-5-13-3)8(10)6-9(11)12/h4-8H,1-3H3/b5-4+
InChIKeyKKIYNLKQAFPSMI-SNAWJCMRSA-N
MW221.13 g/mol
LogP3.74
Rot. Bonds3

About 2-(2,2-dichloroethenyl)-3-[(E)-2-methoxyethenyl]-1,1-dimethylcyclopropane

2-(2,2-dichloroethenyl)-3-[(E)-2-methoxyethenyl]-1,1-dimethylcyclopropane (PubChem CID 23451683) has the molecular formula C10H14Cl2O and a molecular weight of 221.13 g/mol. Its IUPAC name is 2-(2,2-dichloroethenyl)-3-[(E)-2-methoxyethenyl]-1,1-dimethylcyclopropane.

Molecular Properties

Compound Name2-(2,2-dichloroethenyl)-3-[(E)-2-methoxyethenyl]-1,1-dimethylcyclopropane
PubChem CID23451683
Molecular FormulaC10H14Cl2O
Molecular Weight221.13 g/mol
Exact Mass220.04
IUPAC Name2-(2,2-dichloroethenyl)-3-[(E)-2-methoxyethenyl]-1,1-dimethylcyclopropane
SMILESCO/C=C/C1C(C=C(Cl)Cl)C1(C)C
InChIInChI=1S/C10H14Cl2O/c1-10(2)7(4-5-13-3)8(10)6-9(11)12/h4-8H,1-3H3/b5-4+
InChIKeyKKIYNLKQAFPSMI-SNAWJCMRSA-N
XLogP3.74
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.13
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2,2-dichloroethenyl)-3-[(E)-2-methoxyethenyl]-1,1-dimethylcyclopropane?
The IUPAC name of 2-(2,2-dichloroethenyl)-3-[(E)-2-methoxyethenyl]-1,1-dimethylcyclopropane (CID 23451683) is 2-(2,2-dichloroethenyl)-3-[(E)-2-methoxyethenyl]-1,1-dimethylcyclopropane.
What is the SMILES notation for 2-(2,2-dichloroethenyl)-3-[(E)-2-methoxyethenyl]-1,1-dimethylcyclopropane?
The canonical SMILES for 2-(2,2-dichloroethenyl)-3-[(E)-2-methoxyethenyl]-1,1-dimethylcyclopropane is CO/C=C/C1C(C=C(Cl)Cl)C1(C)C.
What is the InChIKey of 2-(2,2-dichloroethenyl)-3-[(E)-2-methoxyethenyl]-1,1-dimethylcyclopropane?
The InChIKey is KKIYNLKQAFPSMI-SNAWJCMRSA-N. The full InChI is InChI=1S/C10H14Cl2O/c1-10(2)7(4-5-13-3)8(10)6-9(11)12/h4-8H,1-3H3/b5-4+.
What are the key properties of 2-(2,2-dichloroethenyl)-3-[(E)-2-methoxyethenyl]-1,1-dimethylcyclopropane?
2-(2,2-dichloroethenyl)-3-[(E)-2-methoxyethenyl]-1,1-dimethylcyclopropane has a molecular weight of 221.13 g/mol, XLogP of 3.74, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dichloroethenyl)-3-[(E)-2-methoxyethenyl]-1,1-dimethylcyclopropane is sourced from PubChem (CID 23451683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).