(E)-2-chloropent-2-ene

C5H9Cl — CID 5463223

IUPAC(E)-2-chloropent-2-ene
SMILESCC/C=C(\C)Cl
InChIInChI=1S/C5H9Cl/c1-3-4-5(2)6/h4H,3H2,1-2H3/b5-4+
InChIKeyKQLXLZMCYSIZHH-SNAWJCMRSA-N
MW104.58 g/mol
LogP2.54
Rot. Bonds1

About (E)-2-chloropent-2-ene

(E)-2-chloropent-2-ene (PubChem CID 5463223) has the molecular formula C5H9Cl and a molecular weight of 104.58 g/mol. Its IUPAC name is (E)-2-chloropent-2-ene.

Molecular Properties

Compound Name(E)-2-chloropent-2-ene
PubChem CID5463223
Molecular FormulaC5H9Cl
Molecular Weight104.58 g/mol
Exact Mass104.04
IUPAC Name(E)-2-chloropent-2-ene
SMILESCC/C=C(\C)Cl
InChIInChI=1S/C5H9Cl/c1-3-4-5(2)6/h4H,3H2,1-2H3/b5-4+
InChIKeyKQLXLZMCYSIZHH-SNAWJCMRSA-N
XLogP2.54
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500104.58
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)-2-chloropent-2-ene?
The IUPAC name of (E)-2-chloropent-2-ene (CID 5463223) is (E)-2-chloropent-2-ene.
What is the SMILES notation for (E)-2-chloropent-2-ene?
The canonical SMILES for (E)-2-chloropent-2-ene is CC/C=C(\C)Cl.
What is the InChIKey of (E)-2-chloropent-2-ene?
The InChIKey is KQLXLZMCYSIZHH-SNAWJCMRSA-N. The full InChI is InChI=1S/C5H9Cl/c1-3-4-5(2)6/h4H,3H2,1-2H3/b5-4+.
What are the key properties of (E)-2-chloropent-2-ene?
(E)-2-chloropent-2-ene has a molecular weight of 104.58 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)-2-chloropent-2-ene is sourced from PubChem (CID 5463223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).