3-chloropent-2-ene

C5H9Cl — CID 54072147

IUPAC3-chloropent-2-ene
SMILESCC=C(Cl)CC
InChIInChI=1S/C5H9Cl/c1-3-5(6)4-2/h3H,4H2,1-2H3
InChIKeyVSQKJRIDGSFPSI-UHFFFAOYSA-N
MW104.58 g/mol
LogP2.54
Rot. Bonds1

About 3-chloropent-2-ene

3-chloropent-2-ene (PubChem CID 54072147) has the molecular formula C5H9Cl and a molecular weight of 104.58 g/mol. Its IUPAC name is 3-chloropent-2-ene.

Molecular Properties

Compound Name3-chloropent-2-ene
PubChem CID54072147
Molecular FormulaC5H9Cl
Molecular Weight104.58 g/mol
Exact Mass104.04
IUPAC Name3-chloropent-2-ene
SMILESCC=C(Cl)CC
InChIInChI=1S/C5H9Cl/c1-3-5(6)4-2/h3H,4H2,1-2H3
InChIKeyVSQKJRIDGSFPSI-UHFFFAOYSA-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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Related Compounds

3-Hexene, 1-chloro-, (3Z)-
CID 6436531
2-Pentene, 5-chloro-, (2E)-
CID 6436376
(Z)-3-Chloro-2-pentene
CID 12705708
2-Pentene, 5-chloro-, (Z)-
CID 6437049
2-Pentene, 5,5,5-trichloro-2-methyl-
CID 109087
3-Hexene, 1-chloro-, (3E)-
CID 6437766
2-Chloro-2-pentene
CID 5463222
(E)-2-chloro-pent-2-ene
CID 5463223
cis-3-Chloro-3-hexene
CID 5462940
(E)-3-Chloro-3-hexene
CID 12550105
3-Hexene, 3-chloro-
CID 519371
2-Hexene, 2-chloro
CID 60089113

Frequently Asked Questions

What is the IUPAC name of 3-chloropent-2-ene?
The IUPAC name of 3-chloropent-2-ene (CID 54072147) is 3-chloropent-2-ene.
What is the SMILES notation for 3-chloropent-2-ene?
The canonical SMILES for 3-chloropent-2-ene is CC=C(Cl)CC.
What is the InChIKey of 3-chloropent-2-ene?
The InChIKey is VSQKJRIDGSFPSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9Cl/c1-3-5(6)4-2/h3H,4H2,1-2H3.
What are the key properties of 3-chloropent-2-ene?
3-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 3-chloropent-2-ene is sourced from PubChem (CID 54072147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).