8-bromooctylcyclopropane

C11H21Br — CID 15027163

IUPAC8-bromooctylcyclopropane
SMILESBrCCCCCCCCC1CC1
InChIInChI=1S/C11H21Br/c12-10-6-4-2-1-3-5-7-11-8-9-11/h11H,1-10H2
InChIKeyGFVBLGLZLGXIQX-UHFFFAOYSA-N
MW233.19 g/mol
LogP4.52
Rot. Bonds8

About 8-bromooctylcyclopropane

8-bromooctylcyclopropane (PubChem CID 15027163) has the molecular formula C11H21Br and a molecular weight of 233.19 g/mol. Its IUPAC name is 8-bromooctylcyclopropane.

Molecular Properties

Compound Name8-bromooctylcyclopropane
PubChem CID15027163
Molecular FormulaC11H21Br
Molecular Weight233.19 g/mol
Exact Mass232.08
IUPAC Name8-bromooctylcyclopropane
SMILESBrCCCCCCCCC1CC1
InChIInChI=1S/C11H21Br/c12-10-6-4-2-1-3-5-7-11-8-9-11/h11H,1-10H2
InChIKeyGFVBLGLZLGXIQX-UHFFFAOYSA-N
XLogP4.52
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.19
LogP ≤ 54.52
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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Related Compounds

1-Bromo-6-methylheptane
CID 104270
1-Bromo-3,7-dimethyloctane
CID 137914
1-Bromo-2-methylnonane
CID 15070877
1-Bromo-6-methyloctane
CID 13548105
5-(Bromomethyl)undecane
CID 20447693
1-Bromo-8-methylnonane
CID 14312906
(1-Bromohexyl)cyclopropane
CID 63358128
(R)-1-bromo-3,7-dimethyloctane
CID 12801557
(3S)-1-Bromo-3,7-dimethyloctane
CID 12801558
1-Bromo-2-methyloctane
CID 14491953
1-Bromo-3-methylnonane
CID 15070878
1-Bromo-6-methylnonane
CID 15070883

Frequently Asked Questions

What is the IUPAC name of 8-bromooctylcyclopropane?
The IUPAC name of 8-bromooctylcyclopropane (CID 15027163) is 8-bromooctylcyclopropane.
What is the SMILES notation for 8-bromooctylcyclopropane?
The canonical SMILES for 8-bromooctylcyclopropane is BrCCCCCCCCC1CC1.
What is the InChIKey of 8-bromooctylcyclopropane?
The InChIKey is GFVBLGLZLGXIQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21Br/c12-10-6-4-2-1-3-5-7-11-8-9-11/h11H,1-10H2.
What are the key properties of 8-bromooctylcyclopropane?
8-bromooctylcyclopropane has a molecular weight of 233.19 g/mol, XLogP of 4.52, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromooctylcyclopropane is sourced from PubChem (CID 15027163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).