1-bromopent-1-ene

C5H9Br — CID 54447993

IUPAC1-bromopent-1-ene
SMILESCCCC=CBr
InChIInChI=1S/C5H9Br/c1-2-3-4-5-6/h4-5H,2-3H2,1H3
InChIKeyWSXIDSNEEOYBFA-UHFFFAOYSA-N
MW149.03 g/mol
LogP2.70
Rot. Bonds2

About 1-bromopent-1-ene

1-bromopent-1-ene (PubChem CID 54447993) has the molecular formula C5H9Br and a molecular weight of 149.03 g/mol. Its IUPAC name is 1-bromopent-1-ene.

Molecular Properties

Compound Name1-bromopent-1-ene
PubChem CID54447993
Molecular FormulaC5H9Br
Molecular Weight149.03 g/mol
Exact Mass147.99
IUPAC Name1-bromopent-1-ene
SMILESCCCC=CBr
InChIInChI=1S/C5H9Br/c1-2-3-4-5-6/h4-5H,2-3H2,1H3
InChIKeyWSXIDSNEEOYBFA-UHFFFAOYSA-N
XLogP2.70
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.03
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-bromopent-1-ene?
The IUPAC name of 1-bromopent-1-ene (CID 54447993) is 1-bromopent-1-ene.
What is the SMILES notation for 1-bromopent-1-ene?
The canonical SMILES for 1-bromopent-1-ene is CCCC=CBr.
What is the InChIKey of 1-bromopent-1-ene?
The InChIKey is WSXIDSNEEOYBFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9Br/c1-2-3-4-5-6/h4-5H,2-3H2,1H3.
What are the key properties of 1-bromopent-1-ene?
1-bromopent-1-ene has a molecular weight of 149.03 g/mol, XLogP of 2.70, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromopent-1-ene is sourced from PubChem (CID 54447993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).