5-(5-bromopentyl)cyclopenta-1,3-diene

C10H15Br — CID 101201216

IUPAC5-(5-bromopentyl)cyclopenta-1,3-diene
SMILESBrCCCCCC1C=CC=C1
InChIInChI=1S/C10H15Br/c11-9-5-1-2-6-10-7-3-4-8-10/h3-4,7-8,10H,1-2,5-6,9H2
InChIKeyMCMGGSMMLLAAOH-UHFFFAOYSA-N
MW215.13 g/mol
LogP3.68
Rot. Bonds5

About 5-(5-bromopentyl)cyclopenta-1,3-diene

5-(5-bromopentyl)cyclopenta-1,3-diene (PubChem CID 101201216) has the molecular formula C10H15Br and a molecular weight of 215.13 g/mol. Its IUPAC name is 5-(5-bromopentyl)cyclopenta-1,3-diene.

Molecular Properties

Compound Name5-(5-bromopentyl)cyclopenta-1,3-diene
PubChem CID101201216
Molecular FormulaC10H15Br
Molecular Weight215.13 g/mol
Exact Mass214.04
IUPAC Name5-(5-bromopentyl)cyclopenta-1,3-diene
SMILESBrCCCCCC1C=CC=C1
InChIInChI=1S/C10H15Br/c11-9-5-1-2-6-10-7-3-4-8-10/h3-4,7-8,10H,1-2,5-6,9H2
InChIKeyMCMGGSMMLLAAOH-UHFFFAOYSA-N
XLogP3.68
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.13
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-(5-bromopentyl)cyclopenta-1,3-diene?
The IUPAC name of 5-(5-bromopentyl)cyclopenta-1,3-diene (CID 101201216) is 5-(5-bromopentyl)cyclopenta-1,3-diene.
What is the SMILES notation for 5-(5-bromopentyl)cyclopenta-1,3-diene?
The canonical SMILES for 5-(5-bromopentyl)cyclopenta-1,3-diene is BrCCCCCC1C=CC=C1.
What is the InChIKey of 5-(5-bromopentyl)cyclopenta-1,3-diene?
The InChIKey is MCMGGSMMLLAAOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15Br/c11-9-5-1-2-6-10-7-3-4-8-10/h3-4,7-8,10H,1-2,5-6,9H2.
What are the key properties of 5-(5-bromopentyl)cyclopenta-1,3-diene?
5-(5-bromopentyl)cyclopenta-1,3-diene has a molecular weight of 215.13 g/mol, XLogP of 3.68, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-bromopentyl)cyclopenta-1,3-diene is sourced from PubChem (CID 101201216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).