2-(2,2-dibromoethenyl)-1,1,3-trimethylcyclopropane

C8H12Br2 — CID 56982589

IUPAC2-(2,2-dibromoethenyl)-1,1,3-trimethylcyclopropane
SMILESCC1C(C=C(Br)Br)C1(C)C
InChIInChI=1S/C8H12Br2/c1-5-6(4-7(9)10)8(5,2)3/h4-6H,1-3H3
InChIKeyANHIQKUMOSLGJL-UHFFFAOYSA-N
MW267.99 g/mol
LogP3.91
Rot. Bonds1

About 2-(2,2-dibromoethenyl)-1,1,3-trimethylcyclopropane

2-(2,2-dibromoethenyl)-1,1,3-trimethylcyclopropane (PubChem CID 56982589) has the molecular formula C8H12Br2 and a molecular weight of 267.99 g/mol. Its IUPAC name is 2-(2,2-dibromoethenyl)-1,1,3-trimethylcyclopropane.

Molecular Properties

Compound Name2-(2,2-dibromoethenyl)-1,1,3-trimethylcyclopropane
PubChem CID56982589
Molecular FormulaC8H12Br2
Molecular Weight267.99 g/mol
Exact Mass265.93
IUPAC Name2-(2,2-dibromoethenyl)-1,1,3-trimethylcyclopropane
SMILESCC1C(C=C(Br)Br)C1(C)C
InChIInChI=1S/C8H12Br2/c1-5-6(4-7(9)10)8(5,2)3/h4-6H,1-3H3
InChIKeyANHIQKUMOSLGJL-UHFFFAOYSA-N
XLogP3.91
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.99
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-(2,2-dibromoethenyl)-1,1,3-trimethylcyclopropane?
The IUPAC name of 2-(2,2-dibromoethenyl)-1,1,3-trimethylcyclopropane (CID 56982589) is 2-(2,2-dibromoethenyl)-1,1,3-trimethylcyclopropane.
What is the SMILES notation for 2-(2,2-dibromoethenyl)-1,1,3-trimethylcyclopropane?
The canonical SMILES for 2-(2,2-dibromoethenyl)-1,1,3-trimethylcyclopropane is CC1C(C=C(Br)Br)C1(C)C.
What is the InChIKey of 2-(2,2-dibromoethenyl)-1,1,3-trimethylcyclopropane?
The InChIKey is ANHIQKUMOSLGJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12Br2/c1-5-6(4-7(9)10)8(5,2)3/h4-6H,1-3H3.
What are the key properties of 2-(2,2-dibromoethenyl)-1,1,3-trimethylcyclopropane?
2-(2,2-dibromoethenyl)-1,1,3-trimethylcyclopropane has a molecular weight of 267.99 g/mol, XLogP of 3.91, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dibromoethenyl)-1,1,3-trimethylcyclopropane is sourced from PubChem (CID 56982589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).