(1-iodo-2-methylpropan-2-yl)phosphane

C4H10IP — CID 18962690

IUPAC(1-iodo-2-methylpropan-2-yl)phosphane
SMILESCC(C)(P)CI
InChIInChI=1S/C4H10IP/c1-4(2,6)3-5/h3,6H2,1-2H3
InChIKeyKUNWNYNDCCMZKZ-UHFFFAOYSA-N
MW216.00 g/mol
LogP2.08
Rot. Bonds1

About (1-iodo-2-methylpropan-2-yl)phosphane

(1-iodo-2-methylpropan-2-yl)phosphane (PubChem CID 18962690) has the molecular formula C4H10IP and a molecular weight of 216.00 g/mol. Its IUPAC name is (1-iodo-2-methylpropan-2-yl)phosphane.

Molecular Properties

Compound Name(1-iodo-2-methylpropan-2-yl)phosphane
PubChem CID18962690
Molecular FormulaC4H10IP
Molecular Weight216.00 g/mol
Exact Mass215.96
IUPAC Name(1-iodo-2-methylpropan-2-yl)phosphane
SMILESCC(C)(P)CI
InChIInChI=1S/C4H10IP/c1-4(2,6)3-5/h3,6H2,1-2H3
InChIKeyKUNWNYNDCCMZKZ-UHFFFAOYSA-N
XLogP2.08
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.00
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze (1-iodo-2-methylpropan-2-yl)phosphane 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-iodo-2-methylpropan-2-yl)phosphane?
The IUPAC name of (1-iodo-2-methylpropan-2-yl)phosphane (CID 18962690) is (1-iodo-2-methylpropan-2-yl)phosphane.
What is the SMILES notation for (1-iodo-2-methylpropan-2-yl)phosphane?
The canonical SMILES for (1-iodo-2-methylpropan-2-yl)phosphane is CC(C)(P)CI.
What is the InChIKey of (1-iodo-2-methylpropan-2-yl)phosphane?
The InChIKey is KUNWNYNDCCMZKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10IP/c1-4(2,6)3-5/h3,6H2,1-2H3.
What are the key properties of (1-iodo-2-methylpropan-2-yl)phosphane?
(1-iodo-2-methylpropan-2-yl)phosphane has a molecular weight of 216.00 g/mol, XLogP of 2.08, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1-iodo-2-methylpropan-2-yl)phosphane is sourced from PubChem (CID 18962690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).