5,5-dibromo-4-methylpent-1-ene

C6H10Br2 — CID 57083571

IUPAC5,5-dibromo-4-methylpent-1-ene
SMILESC=CCC(C)C(Br)Br
InChIInChI=1S/C6H10Br2/c1-3-4-5(2)6(7)8/h3,5-6H,1,4H2,2H3
InChIKeyOLGFHSCHKHPUNX-UHFFFAOYSA-N
MW241.95 g/mol
LogP3.31
Rot. Bonds3

About 5,5-dibromo-4-methylpent-1-ene

5,5-dibromo-4-methylpent-1-ene (PubChem CID 57083571) has the molecular formula C6H10Br2 and a molecular weight of 241.95 g/mol. Its IUPAC name is 5,5-dibromo-4-methylpent-1-ene.

Molecular Properties

Compound Name5,5-dibromo-4-methylpent-1-ene
PubChem CID57083571
Molecular FormulaC6H10Br2
Molecular Weight241.95 g/mol
Exact Mass239.91
IUPAC Name5,5-dibromo-4-methylpent-1-ene
SMILESC=CCC(C)C(Br)Br
InChIInChI=1S/C6H10Br2/c1-3-4-5(2)6(7)8/h3,5-6H,1,4H2,2H3
InChIKeyOLGFHSCHKHPUNX-UHFFFAOYSA-N
XLogP3.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.95
LogP ≤ 53.31
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 5,5-dibromo-4-methylpent-1-ene?
The IUPAC name of 5,5-dibromo-4-methylpent-1-ene (CID 57083571) is 5,5-dibromo-4-methylpent-1-ene.
What is the SMILES notation for 5,5-dibromo-4-methylpent-1-ene?
The canonical SMILES for 5,5-dibromo-4-methylpent-1-ene is C=CCC(C)C(Br)Br.
What is the InChIKey of 5,5-dibromo-4-methylpent-1-ene?
The InChIKey is OLGFHSCHKHPUNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10Br2/c1-3-4-5(2)6(7)8/h3,5-6H,1,4H2,2H3.
What are the key properties of 5,5-dibromo-4-methylpent-1-ene?
5,5-dibromo-4-methylpent-1-ene has a molecular weight of 241.95 g/mol, XLogP of 3.31, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dibromo-4-methylpent-1-ene is sourced from PubChem (CID 57083571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).