1,1-dibromo-2-(dicyclopropylmethylidene)cyclopropane

C10H12Br2 — CID 13226779

IUPAC1,1-dibromo-2-(dicyclopropylmethylidene)cyclopropane
SMILESBrC1(Br)CC1=C(C1CC1)C1CC1
InChIInChI=1S/C10H12Br2/c11-10(12)5-8(10)9(6-1-2-6)7-3-4-7/h6-7H,1-5H2
InChIKeyGNBUAXVHSSDKSN-UHFFFAOYSA-N
MW292.01 g/mol
LogP3.99
Rot. Bonds2

About 1,1-dibromo-2-(dicyclopropylmethylidene)cyclopropane

1,1-dibromo-2-(dicyclopropylmethylidene)cyclopropane (PubChem CID 13226779) has the molecular formula C10H12Br2 and a molecular weight of 292.01 g/mol. Its IUPAC name is 1,1-dibromo-2-(dicyclopropylmethylidene)cyclopropane.

Molecular Properties

Compound Name1,1-dibromo-2-(dicyclopropylmethylidene)cyclopropane
PubChem CID13226779
Molecular FormulaC10H12Br2
Molecular Weight292.01 g/mol
Exact Mass289.93
IUPAC Name1,1-dibromo-2-(dicyclopropylmethylidene)cyclopropane
SMILESBrC1(Br)CC1=C(C1CC1)C1CC1
InChIInChI=1S/C10H12Br2/c11-10(12)5-8(10)9(6-1-2-6)7-3-4-7/h6-7H,1-5H2
InChIKeyGNBUAXVHSSDKSN-UHFFFAOYSA-N
XLogP3.99
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.01
LogP ≤ 53.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,1-dibromo-2-(dicyclopropylmethylidene)cyclopropane?
The IUPAC name of 1,1-dibromo-2-(dicyclopropylmethylidene)cyclopropane (CID 13226779) is 1,1-dibromo-2-(dicyclopropylmethylidene)cyclopropane.
What is the SMILES notation for 1,1-dibromo-2-(dicyclopropylmethylidene)cyclopropane?
The canonical SMILES for 1,1-dibromo-2-(dicyclopropylmethylidene)cyclopropane is BrC1(Br)CC1=C(C1CC1)C1CC1.
What is the InChIKey of 1,1-dibromo-2-(dicyclopropylmethylidene)cyclopropane?
The InChIKey is GNBUAXVHSSDKSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12Br2/c11-10(12)5-8(10)9(6-1-2-6)7-3-4-7/h6-7H,1-5H2.
What are the key properties of 1,1-dibromo-2-(dicyclopropylmethylidene)cyclopropane?
1,1-dibromo-2-(dicyclopropylmethylidene)cyclopropane has a molecular weight of 292.01 g/mol, XLogP of 3.99, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dibromo-2-(dicyclopropylmethylidene)cyclopropane is sourced from PubChem (CID 13226779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).