1-bromo-1-[(1-bromocyclopropyl)-cyclopropylidenemethyl]cyclopropane

C10H12Br2 — CID 12567935

IUPAC1-bromo-1-[(1-bromocyclopropyl)-cyclopropylidenemethyl]cyclopropane
SMILESBrC1(C(=C2CC2)C2(Br)CC2)CC1
InChIInChI=1S/C10H12Br2/c11-9(3-4-9)8(7-1-2-7)10(12)5-6-10/h1-6H2
InChIKeyAJUIMYQHZLCRDG-UHFFFAOYSA-N
MW292.01 g/mol
LogP3.93
Rot. Bonds2

About 1-bromo-1-[(1-bromocyclopropyl)-cyclopropylidenemethyl]cyclopropane

1-bromo-1-[(1-bromocyclopropyl)-cyclopropylidenemethyl]cyclopropane (PubChem CID 12567935) has the molecular formula C10H12Br2 and a molecular weight of 292.01 g/mol. Its IUPAC name is 1-bromo-1-[(1-bromocyclopropyl)-cyclopropylidenemethyl]cyclopropane.

Molecular Properties

Compound Name1-bromo-1-[(1-bromocyclopropyl)-cyclopropylidenemethyl]cyclopropane
PubChem CID12567935
Molecular FormulaC10H12Br2
Molecular Weight292.01 g/mol
Exact Mass289.93
IUPAC Name1-bromo-1-[(1-bromocyclopropyl)-cyclopropylidenemethyl]cyclopropane
SMILESBrC1(C(=C2CC2)C2(Br)CC2)CC1
InChIInChI=1S/C10H12Br2/c11-9(3-4-9)8(7-1-2-7)10(12)5-6-10/h1-6H2
InChIKeyAJUIMYQHZLCRDG-UHFFFAOYSA-N
XLogP3.93
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 ≤ 53.93
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'}

Analyze 1-bromo-1-[(1-bromocyclopropyl)-cyclopropylidenemethyl]cyclopropane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-bromo-1-[(1-bromocyclopropyl)-cyclopropylidenemethyl]cyclopropane?
The IUPAC name of 1-bromo-1-[(1-bromocyclopropyl)-cyclopropylidenemethyl]cyclopropane (CID 12567935) is 1-bromo-1-[(1-bromocyclopropyl)-cyclopropylidenemethyl]cyclopropane.
What is the SMILES notation for 1-bromo-1-[(1-bromocyclopropyl)-cyclopropylidenemethyl]cyclopropane?
The canonical SMILES for 1-bromo-1-[(1-bromocyclopropyl)-cyclopropylidenemethyl]cyclopropane is BrC1(C(=C2CC2)C2(Br)CC2)CC1.
What is the InChIKey of 1-bromo-1-[(1-bromocyclopropyl)-cyclopropylidenemethyl]cyclopropane?
The InChIKey is AJUIMYQHZLCRDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12Br2/c11-9(3-4-9)8(7-1-2-7)10(12)5-6-10/h1-6H2.
What are the key properties of 1-bromo-1-[(1-bromocyclopropyl)-cyclopropylidenemethyl]cyclopropane?
1-bromo-1-[(1-bromocyclopropyl)-cyclopropylidenemethyl]cyclopropane has a molecular weight of 292.01 g/mol, XLogP of 3.93, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-1-[(1-bromocyclopropyl)-cyclopropylidenemethyl]cyclopropane is sourced from PubChem (CID 12567935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).