1,1-dibromo-3-methylpent-1-ene

C6H10Br2 — CID 13115244

IUPAC1,1-dibromo-3-methylpent-1-ene
SMILESCCC(C)C=C(Br)Br
InChIInChI=1S/C6H10Br2/c1-3-5(2)4-6(7)8/h4-5H,3H2,1-2H3
InChIKeyPPVHYRCRKWRZIP-UHFFFAOYSA-N
MW241.95 g/mol
LogP3.66
Rot. Bonds2

About 1,1-dibromo-3-methylpent-1-ene

1,1-dibromo-3-methylpent-1-ene (PubChem CID 13115244) has the molecular formula C6H10Br2 and a molecular weight of 241.95 g/mol. Its IUPAC name is 1,1-dibromo-3-methylpent-1-ene.

Molecular Properties

Compound Name1,1-dibromo-3-methylpent-1-ene
PubChem CID13115244
Molecular FormulaC6H10Br2
Molecular Weight241.95 g/mol
Exact Mass239.91
IUPAC Name1,1-dibromo-3-methylpent-1-ene
SMILESCCC(C)C=C(Br)Br
InChIInChI=1S/C6H10Br2/c1-3-5(2)4-6(7)8/h4-5H,3H2,1-2H3
InChIKeyPPVHYRCRKWRZIP-UHFFFAOYSA-N
XLogP3.66
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.95
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,1-dibromo-3-methylpent-1-ene?
The IUPAC name of 1,1-dibromo-3-methylpent-1-ene (CID 13115244) is 1,1-dibromo-3-methylpent-1-ene.
What is the SMILES notation for 1,1-dibromo-3-methylpent-1-ene?
The canonical SMILES for 1,1-dibromo-3-methylpent-1-ene is CCC(C)C=C(Br)Br.
What is the InChIKey of 1,1-dibromo-3-methylpent-1-ene?
The InChIKey is PPVHYRCRKWRZIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10Br2/c1-3-5(2)4-6(7)8/h4-5H,3H2,1-2H3.
What are the key properties of 1,1-dibromo-3-methylpent-1-ene?
1,1-dibromo-3-methylpent-1-ene has a molecular weight of 241.95 g/mol, XLogP of 3.66, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dibromo-3-methylpent-1-ene is sourced from PubChem (CID 13115244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).