2-(2,2-dibromoethenyl)-1,1-dimethyl-3-propan-2-ylcyclopropane

C10H16Br2 — CID 169302908

IUPAC2-(2,2-dibromoethenyl)-1,1-dimethyl-3-propan-2-ylcyclopropane
SMILESCC(C)C1C(C=C(Br)Br)C1(C)C
InChIInChI=1S/C10H16Br2/c1-6(2)9-7(5-8(11)12)10(9,3)4/h5-7,9H,1-4H3
InChIKeyVWLGDDVQNJNEKX-UHFFFAOYSA-N
MW296.05 g/mol
LogP4.55
Rot. Bonds2

About 2-(2,2-dibromoethenyl)-1,1-dimethyl-3-propan-2-ylcyclopropane

2-(2,2-dibromoethenyl)-1,1-dimethyl-3-propan-2-ylcyclopropane (PubChem CID 169302908) has the molecular formula C10H16Br2 and a molecular weight of 296.05 g/mol. Its IUPAC name is 2-(2,2-dibromoethenyl)-1,1-dimethyl-3-propan-2-ylcyclopropane.

Molecular Properties

Compound Name2-(2,2-dibromoethenyl)-1,1-dimethyl-3-propan-2-ylcyclopropane
PubChem CID169302908
Molecular FormulaC10H16Br2
Molecular Weight296.05 g/mol
Exact Mass293.96
IUPAC Name2-(2,2-dibromoethenyl)-1,1-dimethyl-3-propan-2-ylcyclopropane
SMILESCC(C)C1C(C=C(Br)Br)C1(C)C
InChIInChI=1S/C10H16Br2/c1-6(2)9-7(5-8(11)12)10(9,3)4/h5-7,9H,1-4H3
InChIKeyVWLGDDVQNJNEKX-UHFFFAOYSA-N
XLogP4.55
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.05
LogP ≤ 54.55
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-dimethyl-3-propan-2-ylcyclopropane?
The IUPAC name of 2-(2,2-dibromoethenyl)-1,1-dimethyl-3-propan-2-ylcyclopropane (CID 169302908) is 2-(2,2-dibromoethenyl)-1,1-dimethyl-3-propan-2-ylcyclopropane.
What is the SMILES notation for 2-(2,2-dibromoethenyl)-1,1-dimethyl-3-propan-2-ylcyclopropane?
The canonical SMILES for 2-(2,2-dibromoethenyl)-1,1-dimethyl-3-propan-2-ylcyclopropane is CC(C)C1C(C=C(Br)Br)C1(C)C.
What is the InChIKey of 2-(2,2-dibromoethenyl)-1,1-dimethyl-3-propan-2-ylcyclopropane?
The InChIKey is VWLGDDVQNJNEKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16Br2/c1-6(2)9-7(5-8(11)12)10(9,3)4/h5-7,9H,1-4H3.
What are the key properties of 2-(2,2-dibromoethenyl)-1,1-dimethyl-3-propan-2-ylcyclopropane?
2-(2,2-dibromoethenyl)-1,1-dimethyl-3-propan-2-ylcyclopropane has a molecular weight of 296.05 g/mol, XLogP of 4.55, 2 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-dimethyl-3-propan-2-ylcyclopropane is sourced from PubChem (CID 169302908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).