1-iodopropane;zinc

C3H7IZn — CID 87687648

IUPAC1-iodopropane;zinc
SMILESCCCI.[Zn]
InChIInChI=1S/C3H7I.Zn/c1-2-3-4;/h2-3H2,1H3;
InChIKeyLMUGPCBGMWLIPT-UHFFFAOYSA-N
MW235.38 g/mol
LogP1.83
Rot. Bonds1

About 1-iodopropane;zinc

1-iodopropane;zinc (PubChem CID 87687648) has the molecular formula C3H7IZn and a molecular weight of 235.38 g/mol. Its IUPAC name is 1-iodopropane;zinc.

Molecular Properties

Compound Name1-iodopropane;zinc
PubChem CID87687648
Molecular FormulaC3H7IZn
Molecular Weight235.38 g/mol
Exact Mass233.89
IUPAC Name1-iodopropane;zinc
SMILESCCCI.[Zn]
InChIInChI=1S/C3H7I.Zn/c1-2-3-4;/h2-3H2,1H3;
InChIKeyLMUGPCBGMWLIPT-UHFFFAOYSA-N
XLogP1.83
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.38
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 1-iodopropane;zinc with MolForge

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

Launch Full Analysis

Related Compounds

iodoethane;zinc
CID 87126812
N,N-diethylethanamine;1-iodopropane
CID 91479999
iodoethane;iodomethane;2-iodo-2-methylpropane;1-iodopropane
CID 173246195
1-iodobutane;iodomethane;tris(1-iodopentane);1-iodopropane
CID 159910263
iodo(1,2-13C2)ethane
CID 10855737
CID 175765895
CID 175765895
iodoethane;pentane
CID 142801861
CID 172807183
CID 172807183
argon;iodoethane
CID 22146514
ethylphosphanium;zinc;iodide
CID 172759663
butane;hydron;zinc
CID 173400391
1-iodooctane;phosphane
CID 88789975

Frequently Asked Questions

What is the IUPAC name of 1-iodopropane;zinc?
The IUPAC name of 1-iodopropane;zinc (CID 87687648) is 1-iodopropane;zinc.
What is the SMILES notation for 1-iodopropane;zinc?
The canonical SMILES for 1-iodopropane;zinc is CCCI.[Zn].
What is the InChIKey of 1-iodopropane;zinc?
The InChIKey is LMUGPCBGMWLIPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7I.Zn/c1-2-3-4;/h2-3H2,1H3;.
What are the key properties of 1-iodopropane;zinc?
1-iodopropane;zinc has a molecular weight of 235.38 g/mol, XLogP of 1.83, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-iodopropane;zinc is sourced from PubChem (CID 87687648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).