butane;cadmium(2+);chloride

C4H9CdCl — CID 22477088

IUPACbutane;cadmium(2+);chloride
SMILES[CH2-]CCC.[Cd+2].[Cl-]
InChIInChI=1S/C4H9.Cd.ClH/c1-3-4-2;;/h1,3-4H2,2H3;;1H/q-1;+2;/p-1
InChIKeyISYVUQXRMQAQMQ-UHFFFAOYSA-M
MW204.98 g/mol
LogP-1.38
Rot. Bonds1

About butane;cadmium(2+);chloride

butane;cadmium(2+);chloride (PubChem CID 22477088) has the molecular formula C4H9CdCl and a molecular weight of 204.98 g/mol. Its IUPAC name is butane;cadmium(2+);chloride.

Molecular Properties

Compound Namebutane;cadmium(2+);chloride
PubChem CID22477088
Molecular FormulaC4H9CdCl
Molecular Weight204.98 g/mol
Exact Mass205.94
IUPAC Namebutane;cadmium(2+);chloride
SMILES[CH2-]CCC.[Cd+2].[Cl-]
InChIInChI=1S/C4H9.Cd.ClH/c1-3-4-2;;/h1,3-4H2,2H3;;1H/q-1;+2;/p-1
InChIKeyISYVUQXRMQAQMQ-UHFFFAOYSA-M
XLogP-1.38
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.98
LogP ≤ 5-1.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze butane;cadmium(2+);chloride 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

butane;carbanide;tungsten(2+);yttrium
CID 167712375
magnesium;butane;chloride
CID 6101660
butane;zirconium(4+);dichloride
CID 87374724
butane;propane;yttrium
CID 59895294
butane;phosphane;ruthenium(4+);chloride
CID 88846853
butane;platinum(2+)
CID 85439871
butane;terbium(3+)
CID 21057379
butane;lithium(1-)
CID 154172744
butane;tris(rubidium(1+))
CID 59203345
butane;nickel
CID 57419181
butane;ethene;methane;tris(yttrium)
CID 158409279
lithium;azane;butane
CID 22988541

Frequently Asked Questions

What is the IUPAC name of butane;cadmium(2+);chloride?
The IUPAC name of butane;cadmium(2+);chloride (CID 22477088) is butane;cadmium(2+);chloride.
What is the SMILES notation for butane;cadmium(2+);chloride?
The canonical SMILES for butane;cadmium(2+);chloride is [CH2-]CCC.[Cd+2].[Cl-].
What is the InChIKey of butane;cadmium(2+);chloride?
The InChIKey is ISYVUQXRMQAQMQ-UHFFFAOYSA-M. The full InChI is InChI=1S/C4H9.Cd.ClH/c1-3-4-2;;/h1,3-4H2,2H3;;1H/q-1;+2;/p-1.
What are the key properties of butane;cadmium(2+);chloride?
butane;cadmium(2+);chloride has a molecular weight of 204.98 g/mol, XLogP of -1.38, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for butane;cadmium(2+);chloride is sourced from PubChem (CID 22477088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).