1,2-dibromocyclodecane

C10H18Br2 — CID 73175476

IUPAC1,2-dibromocyclodecane
SMILESBrC1CCCCCCCCC1Br
InChIInChI=1S/C10H18Br2/c11-9-7-5-3-1-2-4-6-8-10(9)12/h9-10H,1-8H2
InChIKeyQYZIQNSPCPRPGV-UHFFFAOYSA-N
MW298.06 g/mol
LogP4.65
Rot. Bonds

About 1,2-dibromocyclodecane

1,2-dibromocyclodecane (PubChem CID 73175476) has the molecular formula C10H18Br2 and a molecular weight of 298.06 g/mol. Its IUPAC name is 1,2-dibromocyclodecane.

Molecular Properties

Compound Name1,2-dibromocyclodecane
PubChem CID73175476
Molecular FormulaC10H18Br2
Molecular Weight298.06 g/mol
Exact Mass295.98
IUPAC Name1,2-dibromocyclodecane
SMILESBrC1CCCCCCCCC1Br
InChIInChI=1S/C10H18Br2/c11-9-7-5-3-1-2-4-6-8-10(9)12/h9-10H,1-8H2
InChIKeyQYZIQNSPCPRPGV-UHFFFAOYSA-N
XLogP4.65
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.06
LogP ≤ 54.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,2-dibromocyclodecane?
The IUPAC name of 1,2-dibromocyclodecane (CID 73175476) is 1,2-dibromocyclodecane.
What is the SMILES notation for 1,2-dibromocyclodecane?
The canonical SMILES for 1,2-dibromocyclodecane is BrC1CCCCCCCCC1Br.
What is the InChIKey of 1,2-dibromocyclodecane?
The InChIKey is QYZIQNSPCPRPGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18Br2/c11-9-7-5-3-1-2-4-6-8-10(9)12/h9-10H,1-8H2.
What are the key properties of 1,2-dibromocyclodecane?
1,2-dibromocyclodecane has a molecular weight of 298.06 g/mol, XLogP of 4.65, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dibromocyclodecane is sourced from PubChem (CID 73175476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).