CID 162691770

C6H3Cl2Se — CID 162691770

IUPAC—
SMILESClc1cccc([Se])c1Cl
InChIInChI=1S/C6H3Cl2Se/c7-4-2-1-3-5(9)6(4)8/h1-3H
InChIKeyFQTUBXSJYLENLV-UHFFFAOYSA-N
MW224.96 g/mol
LogP1.79
Rot. Bonds

About CID 162691770

CID 162691770 (PubChem CID 162691770) has the molecular formula C6H3Cl2Se and a molecular weight of 224.96 g/mol.

Molecular Properties

Compound NameCID 162691770
PubChem CID162691770
Molecular FormulaC6H3Cl2Se
Molecular Weight224.96 g/mol
Exact Mass224.88
IUPAC Name—
SMILESClc1cccc([Se])c1Cl
InChIInChI=1S/C6H3Cl2Se/c7-4-2-1-3-5(9)6(4)8/h1-3H
InChIKeyFQTUBXSJYLENLV-UHFFFAOYSA-N
XLogP1.79
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.96
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze CID 162691770 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

CID 173103986
CID 173103986
2,3-dichlorobenzenecarboselenoyl chloride
CID 150296401
potassium;2,3-dichlorophenol;hydride
CID 174676852
(2,3-dichlorophenyl)azanide;platinum
CID 174721930
1-(2,3-dichlorophenyl)ethanamine chloride
CID 51371192
benzene;ruthenium;1,2,3,4-tetrachlorobenzene
CID 173000636
1,2-dichloro-3-(chloromethyl)benzene;zirconium
CID 87866598
N-(2,3-dichlorophenyl)hydroxylamine
CID 18942828
1,2-dichloro-3-(2,6-dichlorophenoxy)benzene
CID 72941859
(2,3-dichlorophenyl)methylazanium
CID 6951258
(2,3-dichlorophenyl)methanediamine
CID 139660481
potassium (2,3-dichlorophenyl)-trifluoroboranuide
CID 63676783

Frequently Asked Questions

What is the IUPAC name of CID 162691770?
The IUPAC name of CID 162691770 (CID 162691770) is not available.
What is the SMILES notation for CID 162691770?
The canonical SMILES for CID 162691770 is Clc1cccc([Se])c1Cl.
What is the InChIKey of CID 162691770?
The InChIKey is FQTUBXSJYLENLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3Cl2Se/c7-4-2-1-3-5(9)6(4)8/h1-3H.
What are the key properties of CID 162691770?
CID 162691770 has a molecular weight of 224.96 g/mol, XLogP of 1.79, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 162691770 is sourced from PubChem (CID 162691770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).