[(E)-1-chloroprop-1-enyl]cyclopropane

C6H9Cl — CID 119097932

IUPAC[(E)-1-chloroprop-1-enyl]cyclopropane
SMILESC/C=C(/Cl)C1CC1
InChIInChI=1S/C6H9Cl/c1-2-6(7)5-3-4-5/h2,5H,3-4H2,1H3/b6-2+
InChIKeyWBRUIKSWQOVMFF-QHHAFSJGSA-N
MW116.59 g/mol
LogP2.54
Rot. Bonds1

About [(E)-1-chloroprop-1-enyl]cyclopropane

[(E)-1-chloroprop-1-enyl]cyclopropane (PubChem CID 119097932) has the molecular formula C6H9Cl and a molecular weight of 116.59 g/mol. Its IUPAC name is [(E)-1-chloroprop-1-enyl]cyclopropane.

Molecular Properties

Compound Name[(E)-1-chloroprop-1-enyl]cyclopropane
PubChem CID119097932
Molecular FormulaC6H9Cl
Molecular Weight116.59 g/mol
Exact Mass116.04
IUPAC Name[(E)-1-chloroprop-1-enyl]cyclopropane
SMILESC/C=C(/Cl)C1CC1
InChIInChI=1S/C6H9Cl/c1-2-6(7)5-3-4-5/h2,5H,3-4H2,1H3/b6-2+
InChIKeyWBRUIKSWQOVMFF-QHHAFSJGSA-N
XLogP2.54
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.59
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of [(E)-1-chloroprop-1-enyl]cyclopropane?
The IUPAC name of [(E)-1-chloroprop-1-enyl]cyclopropane (CID 119097932) is [(E)-1-chloroprop-1-enyl]cyclopropane.
What is the SMILES notation for [(E)-1-chloroprop-1-enyl]cyclopropane?
The canonical SMILES for [(E)-1-chloroprop-1-enyl]cyclopropane is C/C=C(/Cl)C1CC1.
What is the InChIKey of [(E)-1-chloroprop-1-enyl]cyclopropane?
The InChIKey is WBRUIKSWQOVMFF-QHHAFSJGSA-N. The full InChI is InChI=1S/C6H9Cl/c1-2-6(7)5-3-4-5/h2,5H,3-4H2,1H3/b6-2+.
What are the key properties of [(E)-1-chloroprop-1-enyl]cyclopropane?
[(E)-1-chloroprop-1-enyl]cyclopropane has a molecular weight of 116.59 g/mol, XLogP of 2.54, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-1-chloroprop-1-enyl]cyclopropane is sourced from PubChem (CID 119097932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).