3-chloro-2-methylpent-2-ene

C6H11Cl — CID 22613989

IUPAC3-chloro-2-methylpent-2-ene
SMILESCCC(Cl)=C(C)C
InChIInChI=1S/C6H11Cl/c1-4-6(7)5(2)3/h4H2,1-3H3
InChIKeyPUZDQBBMVXSEPB-UHFFFAOYSA-N
MW118.61 g/mol
LogP2.93
Rot. Bonds1

About 3-chloro-2-methylpent-2-ene

3-chloro-2-methylpent-2-ene (PubChem CID 22613989) has the molecular formula C6H11Cl and a molecular weight of 118.61 g/mol. Its IUPAC name is 3-chloro-2-methylpent-2-ene.

Molecular Properties

Compound Name3-chloro-2-methylpent-2-ene
PubChem CID22613989
Molecular FormulaC6H11Cl
Molecular Weight118.61 g/mol
Exact Mass118.05
IUPAC Name3-chloro-2-methylpent-2-ene
SMILESCCC(Cl)=C(C)C
InChIInChI=1S/C6H11Cl/c1-4-6(7)5(2)3/h4H2,1-3H3
InChIKeyPUZDQBBMVXSEPB-UHFFFAOYSA-N
XLogP2.93
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.61
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-2-methylpent-2-ene?
The IUPAC name of 3-chloro-2-methylpent-2-ene (CID 22613989) is 3-chloro-2-methylpent-2-ene.
What is the SMILES notation for 3-chloro-2-methylpent-2-ene?
The canonical SMILES for 3-chloro-2-methylpent-2-ene is CCC(Cl)=C(C)C.
What is the InChIKey of 3-chloro-2-methylpent-2-ene?
The InChIKey is PUZDQBBMVXSEPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11Cl/c1-4-6(7)5(2)3/h4H2,1-3H3.
What are the key properties of 3-chloro-2-methylpent-2-ene?
3-chloro-2-methylpent-2-ene has a molecular weight of 118.61 g/mol, XLogP of 2.93, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2-methylpent-2-ene is sourced from PubChem (CID 22613989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).