1-bromocyclopentene

C5H7Br — CID 10964660

IUPAC1-bromocyclopentene
SMILESBrC1=CCCC1
InChIInChI=1S/C5H7Br/c6-5-3-1-2-4-5/h3H,1-2,4H2
InChIKeyXNHUZSZMXSLTQL-UHFFFAOYSA-N
MW147.02 g/mol
LogP2.45
Rot. Bonds

About 1-bromocyclopentene

1-bromocyclopentene (PubChem CID 10964660) has the molecular formula C5H7Br and a molecular weight of 147.02 g/mol. Its IUPAC name is 1-bromocyclopentene.

Molecular Properties

Compound Name1-bromocyclopentene
PubChem CID10964660
Molecular FormulaC5H7Br
Molecular Weight147.02 g/mol
Exact Mass145.97
IUPAC Name1-bromocyclopentene
SMILESBrC1=CCCC1
InChIInChI=1S/C5H7Br/c6-5-3-1-2-4-5/h3H,1-2,4H2
InChIKeyXNHUZSZMXSLTQL-UHFFFAOYSA-N
XLogP2.45
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.02
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-bromocyclopentene?
The IUPAC name of 1-bromocyclopentene (CID 10964660) is 1-bromocyclopentene.
What is the SMILES notation for 1-bromocyclopentene?
The canonical SMILES for 1-bromocyclopentene is BrC1=CCCC1.
What is the InChIKey of 1-bromocyclopentene?
The InChIKey is XNHUZSZMXSLTQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7Br/c6-5-3-1-2-4-5/h3H,1-2,4H2.
What are the key properties of 1-bromocyclopentene?
1-bromocyclopentene has a molecular weight of 147.02 g/mol, XLogP of 2.45, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromocyclopentene is sourced from PubChem (CID 10964660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).