1-bromo-2-[(E)-prop-1-enyl]cyclopentene

C8H11Br — CID 10750070

IUPAC1-bromo-2-[(E)-prop-1-enyl]cyclopentene
SMILESC/C=C/C1=C(Br)CCC1
InChIInChI=1S/C8H11Br/c1-2-4-7-5-3-6-8(7)9/h2,4H,3,5-6H2,1H3/b4-2+
InChIKeyRLBJWLVJBQOKEX-DUXPYHPUSA-N
MW187.08 g/mol
LogP3.40
Rot. Bonds1

About 1-bromo-2-[(E)-prop-1-enyl]cyclopentene

1-bromo-2-[(E)-prop-1-enyl]cyclopentene (PubChem CID 10750070) has the molecular formula C8H11Br and a molecular weight of 187.08 g/mol. Its IUPAC name is 1-bromo-2-[(E)-prop-1-enyl]cyclopentene.

Molecular Properties

Compound Name1-bromo-2-[(E)-prop-1-enyl]cyclopentene
PubChem CID10750070
Molecular FormulaC8H11Br
Molecular Weight187.08 g/mol
Exact Mass186.00
IUPAC Name1-bromo-2-[(E)-prop-1-enyl]cyclopentene
SMILESC/C=C/C1=C(Br)CCC1
InChIInChI=1S/C8H11Br/c1-2-4-7-5-3-6-8(7)9/h2,4H,3,5-6H2,1H3/b4-2+
InChIKeyRLBJWLVJBQOKEX-DUXPYHPUSA-N
XLogP3.40
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.08
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-bromo-2-[(E)-prop-1-enyl]cyclopentene?
The IUPAC name of 1-bromo-2-[(E)-prop-1-enyl]cyclopentene (CID 10750070) is 1-bromo-2-[(E)-prop-1-enyl]cyclopentene.
What is the SMILES notation for 1-bromo-2-[(E)-prop-1-enyl]cyclopentene?
The canonical SMILES for 1-bromo-2-[(E)-prop-1-enyl]cyclopentene is C/C=C/C1=C(Br)CCC1.
What is the InChIKey of 1-bromo-2-[(E)-prop-1-enyl]cyclopentene?
The InChIKey is RLBJWLVJBQOKEX-DUXPYHPUSA-N. The full InChI is InChI=1S/C8H11Br/c1-2-4-7-5-3-6-8(7)9/h2,4H,3,5-6H2,1H3/b4-2+.
What are the key properties of 1-bromo-2-[(E)-prop-1-enyl]cyclopentene?
1-bromo-2-[(E)-prop-1-enyl]cyclopentene has a molecular weight of 187.08 g/mol, XLogP of 3.40, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-2-[(E)-prop-1-enyl]cyclopentene is sourced from PubChem (CID 10750070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).