dichloromethane;propane

C4H10Cl2 — CID 22480796

IUPACdichloromethane;propane
SMILESCCC.ClCCl
InChIInChI=1S/C3H8.CH2Cl2/c1-3-2;2-1-3/h3H2,1-2H3;1H2
InChIKeyMQGGQRIVBWMETK-UHFFFAOYSA-N
MW129.03 g/mol
LogP2.84
Rot. Bonds

About dichloromethane;propane

dichloromethane;propane (PubChem CID 22480796) has the molecular formula C4H10Cl2 and a molecular weight of 129.03 g/mol. Its IUPAC name is dichloromethane;propane.

Molecular Properties

Compound Namedichloromethane;propane
PubChem CID22480796
Molecular FormulaC4H10Cl2
Molecular Weight129.03 g/mol
Exact Mass128.02
IUPAC Namedichloromethane;propane
SMILESCCC.ClCCl
InChIInChI=1S/C3H8.CH2Cl2/c1-3-2;2-1-3/h3H2,1-2H3;1H2
InChIKeyMQGGQRIVBWMETK-UHFFFAOYSA-N
XLogP2.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.03
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze dichloromethane;propane 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 dichloromethane;propane?
The IUPAC name of dichloromethane;propane (CID 22480796) is dichloromethane;propane.
What is the SMILES notation for dichloromethane;propane?
The canonical SMILES for dichloromethane;propane is CCC.ClCCl.
What is the InChIKey of dichloromethane;propane?
The InChIKey is MQGGQRIVBWMETK-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8.CH2Cl2/c1-3-2;2-1-3/h3H2,1-2H3;1H2.
What are the key properties of dichloromethane;propane?
dichloromethane;propane has a molecular weight of 129.03 g/mol, XLogP of 2.84, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dichloromethane;propane is sourced from PubChem (CID 22480796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).