[(2S)-butan-2-yl]arsane

C4H11As — CID 173469724

IUPAC[(2S)-butan-2-yl]arsane
SMILESCC[C@H](C)[AsH2]
InChIInChI=1S/C4H11As/c1-3-4(2)5/h4H,3,5H2,1-2H3/t4-/m0/s1
InChIKeyDYFNMWAAEMCIBX-BYPYZUCNSA-N
MW134.05 g/mol
LogP0.84
Rot. Bonds1

About [(2S)-butan-2-yl]arsane

[(2S)-butan-2-yl]arsane (PubChem CID 173469724) has the molecular formula C4H11As and a molecular weight of 134.05 g/mol. Its IUPAC name is [(2S)-butan-2-yl]arsane.

Molecular Properties

Compound Name[(2S)-butan-2-yl]arsane
PubChem CID173469724
Molecular FormulaC4H11As
Molecular Weight134.05 g/mol
Exact Mass134.01
IUPAC Name[(2S)-butan-2-yl]arsane
SMILESCC[C@H](C)[AsH2]
InChIInChI=1S/C4H11As/c1-3-4(2)5/h4H,3,5H2,1-2H3/t4-/m0/s1
InChIKeyDYFNMWAAEMCIBX-BYPYZUCNSA-N
XLogP0.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.05
LogP ≤ 50.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze [(2S)-butan-2-yl]arsane 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 [(2S)-butan-2-yl]arsane?
The IUPAC name of [(2S)-butan-2-yl]arsane (CID 173469724) is [(2S)-butan-2-yl]arsane.
What is the SMILES notation for [(2S)-butan-2-yl]arsane?
The canonical SMILES for [(2S)-butan-2-yl]arsane is CC[C@H](C)[AsH2].
What is the InChIKey of [(2S)-butan-2-yl]arsane?
The InChIKey is DYFNMWAAEMCIBX-BYPYZUCNSA-N. The full InChI is InChI=1S/C4H11As/c1-3-4(2)5/h4H,3,5H2,1-2H3/t4-/m0/s1.
What are the key properties of [(2S)-butan-2-yl]arsane?
[(2S)-butan-2-yl]arsane has a molecular weight of 134.05 g/mol, XLogP of 0.84, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S)-butan-2-yl]arsane is sourced from PubChem (CID 173469724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).