10,10-dibromobicyclo[7.1.0]decane

C10H16Br2 — CID 12759792

IUPAC10,10-dibromobicyclo[7.1.0]decane
SMILESBrC1(Br)C2CCCCCCCC21
InChIInChI=1S/C10H16Br2/c11-10(12)8-6-4-2-1-3-5-7-9(8)10/h8-9H,1-7H2
InChIKeyWLQQXRGTTTXPHN-UHFFFAOYSA-N
MW296.05 g/mol
LogP4.46
Rot. Bonds

About 10,10-dibromobicyclo[7.1.0]decane

10,10-dibromobicyclo[7.1.0]decane (PubChem CID 12759792) has the molecular formula C10H16Br2 and a molecular weight of 296.05 g/mol. Its IUPAC name is 10,10-dibromobicyclo[7.1.0]decane.

Molecular Properties

Compound Name10,10-dibromobicyclo[7.1.0]decane
PubChem CID12759792
Molecular FormulaC10H16Br2
Molecular Weight296.05 g/mol
Exact Mass293.96
IUPAC Name10,10-dibromobicyclo[7.1.0]decane
SMILESBrC1(Br)C2CCCCCCCC21
InChIInChI=1S/C10H16Br2/c11-10(12)8-6-4-2-1-3-5-7-9(8)10/h8-9H,1-7H2
InChIKeyWLQQXRGTTTXPHN-UHFFFAOYSA-N
XLogP4.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.05
LogP ≤ 54.46
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 10,10-dibromobicyclo[7.1.0]decane?
The IUPAC name of 10,10-dibromobicyclo[7.1.0]decane (CID 12759792) is 10,10-dibromobicyclo[7.1.0]decane.
What is the SMILES notation for 10,10-dibromobicyclo[7.1.0]decane?
The canonical SMILES for 10,10-dibromobicyclo[7.1.0]decane is BrC1(Br)C2CCCCCCCC21.
What is the InChIKey of 10,10-dibromobicyclo[7.1.0]decane?
The InChIKey is WLQQXRGTTTXPHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16Br2/c11-10(12)8-6-4-2-1-3-5-7-9(8)10/h8-9H,1-7H2.
What are the key properties of 10,10-dibromobicyclo[7.1.0]decane?
10,10-dibromobicyclo[7.1.0]decane has a molecular weight of 296.05 g/mol, XLogP of 4.46, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 10,10-dibromobicyclo[7.1.0]decane is sourced from PubChem (CID 12759792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).