1,1-dichloro-2-(2-ethenylpent-4-enyl)cyclopropane

C10H14Cl2 — CID 173322830

IUPAC1,1-dichloro-2-(2-ethenylpent-4-enyl)cyclopropane
SMILESC=CCC(C=C)CC1CC1(Cl)Cl
InChIInChI=1S/C10H14Cl2/c1-3-5-8(4-2)6-9-7-10(9,11)12/h3-4,8-9H,1-2,5-7H2
InChIKeySIUSDFOPWXYZLC-UHFFFAOYSA-N
MW205.13 g/mol
LogP3.95
Rot. Bonds5

About 1,1-dichloro-2-(2-ethenylpent-4-enyl)cyclopropane

1,1-dichloro-2-(2-ethenylpent-4-enyl)cyclopropane (PubChem CID 173322830) has the molecular formula C10H14Cl2 and a molecular weight of 205.13 g/mol. Its IUPAC name is 1,1-dichloro-2-(2-ethenylpent-4-enyl)cyclopropane.

Molecular Properties

Compound Name1,1-dichloro-2-(2-ethenylpent-4-enyl)cyclopropane
PubChem CID173322830
Molecular FormulaC10H14Cl2
Molecular Weight205.13 g/mol
Exact Mass204.05
IUPAC Name1,1-dichloro-2-(2-ethenylpent-4-enyl)cyclopropane
SMILESC=CCC(C=C)CC1CC1(Cl)Cl
InChIInChI=1S/C10H14Cl2/c1-3-5-8(4-2)6-9-7-10(9,11)12/h3-4,8-9H,1-2,5-7H2
InChIKeySIUSDFOPWXYZLC-UHFFFAOYSA-N
XLogP3.95
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.13
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,1-dichloro-2-(2-ethenylpent-4-enyl)cyclopropane?
The IUPAC name of 1,1-dichloro-2-(2-ethenylpent-4-enyl)cyclopropane (CID 173322830) is 1,1-dichloro-2-(2-ethenylpent-4-enyl)cyclopropane.
What is the SMILES notation for 1,1-dichloro-2-(2-ethenylpent-4-enyl)cyclopropane?
The canonical SMILES for 1,1-dichloro-2-(2-ethenylpent-4-enyl)cyclopropane is C=CCC(C=C)CC1CC1(Cl)Cl.
What is the InChIKey of 1,1-dichloro-2-(2-ethenylpent-4-enyl)cyclopropane?
The InChIKey is SIUSDFOPWXYZLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14Cl2/c1-3-5-8(4-2)6-9-7-10(9,11)12/h3-4,8-9H,1-2,5-7H2.
What are the key properties of 1,1-dichloro-2-(2-ethenylpent-4-enyl)cyclopropane?
1,1-dichloro-2-(2-ethenylpent-4-enyl)cyclopropane has a molecular weight of 205.13 g/mol, XLogP of 3.95, 5 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-ethenylpent-4-enyl)cyclopropane is sourced from PubChem (CID 173322830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).