11,11-dibromobicyclo[8.1.0]undecane

C11H18Br2 — CID 12759798

IUPAC11,11-dibromobicyclo[8.1.0]undecane
SMILESBrC1(Br)C2CCCCCCCCC21
InChIInChI=1S/C11H18Br2/c12-11(13)9-7-5-3-1-2-4-6-8-10(9)11/h9-10H,1-8H2
InChIKeyHHUURFZEMBTMKS-UHFFFAOYSA-N
MW310.07 g/mol
LogP4.85
Rot. Bonds

About 11,11-dibromobicyclo[8.1.0]undecane

11,11-dibromobicyclo[8.1.0]undecane (PubChem CID 12759798) has the molecular formula C11H18Br2 and a molecular weight of 310.07 g/mol. Its IUPAC name is 11,11-dibromobicyclo[8.1.0]undecane.

Molecular Properties

Compound Name11,11-dibromobicyclo[8.1.0]undecane
PubChem CID12759798
Molecular FormulaC11H18Br2
Molecular Weight310.07 g/mol
Exact Mass307.98
IUPAC Name11,11-dibromobicyclo[8.1.0]undecane
SMILESBrC1(Br)C2CCCCCCCCC21
InChIInChI=1S/C11H18Br2/c12-11(13)9-7-5-3-1-2-4-6-8-10(9)11/h9-10H,1-8H2
InChIKeyHHUURFZEMBTMKS-UHFFFAOYSA-N
XLogP4.85
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.07
LogP ≤ 54.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

10,10-dibromobicyclo[7.1.0]decane
CID 12759792
(1R,4R,6S,9S)-5,5,10,10-tetrabromotricyclo[7.1.0.04,6]decane
CID 1220422
CID 134889286
CID 134889286
CID 134993535
CID 134993535
1'-bromo-1'-fluorospiro[bicyclo[6.1.0]nonane-9,2'-cyclopropane]
CID 135061399
(1S,4E,8S)-9,9-dibromobicyclo[6.1.0]non-4-ene
CID 98156795
9,9-difluorobicyclo[6.1.0]nonane
CID 12610907
(1S,2R,6S)-7,7-dibromo-2-methylbicyclo[4.1.0]heptane
CID 124921029
(2R)-2-cyclohexyl-1,1-difluorocyclohexane
CID 125450825
4,4,13,13-tetrabromotetracyclo[5.5.1.01,7.03,5]tridecane
CID 90487319
1,2-dibromo-1-methylcyclooctane
CID 18443823
(1S,3S,5S,7R)-4,4,13,13-tetrabromotetracyclo[5.5.1.01,7.03,5]tridecane
CID 98633979

Frequently Asked Questions

What is the IUPAC name of 11,11-dibromobicyclo[8.1.0]undecane?
The IUPAC name of 11,11-dibromobicyclo[8.1.0]undecane (CID 12759798) is 11,11-dibromobicyclo[8.1.0]undecane.
What is the SMILES notation for 11,11-dibromobicyclo[8.1.0]undecane?
The canonical SMILES for 11,11-dibromobicyclo[8.1.0]undecane is BrC1(Br)C2CCCCCCCCC21.
What is the InChIKey of 11,11-dibromobicyclo[8.1.0]undecane?
The InChIKey is HHUURFZEMBTMKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18Br2/c12-11(13)9-7-5-3-1-2-4-6-8-10(9)11/h9-10H,1-8H2.
What are the key properties of 11,11-dibromobicyclo[8.1.0]undecane?
11,11-dibromobicyclo[8.1.0]undecane has a molecular weight of 310.07 g/mol, XLogP of 4.85, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 11,11-dibromobicyclo[8.1.0]undecane is sourced from PubChem (CID 12759798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).