Investigation of Structure–Boiling Point Correlations of Carbonyl Compounds through Molecular Descriptor Analysis

Abstract: This study investigates the relationship between molecular structure and boiling points for a series of organic compounds. A multilinear regression model was developed for a dataset of 25 carbonyl compounds, yielding a strong correlation coefficient of. Additionally, inter-correlations among various molecular descriptors were examined to better understand their influence on boiling point behavior.

Institutions

Publication Details

Journal
Zenodo (CERN European Organization for Nuclear Research)
Published
2025-06-30
DOI
https://doi.org/10.5281/zenodo.15672031
Primary Topic
Computational Drug Discovery Methods
Type
article
Field-Weighted Citation Impact
0.00
Controls
|||
ALL TIME
JAN
FEB
MAR
APR
MAY
JUN
JUL
AUG
SEP
OCT
article

Investigation of Structure–Boiling Point Correlations of Carbonyl Compounds through Molecular Descriptor Analysis

Zenodo (CERN European Organization for Nuclear Research)
Computational Drug Discovery Methods
article

Investigation of Structure–Boiling Point Correlations of Carbonyl Compounds through Molecular Descriptor Analysis

article en

Abstract

Abstract: This study investigates the relationship between molecular structure and boiling points for a series of organic compounds. A multilinear regression model was developed for a dataset of 25 carbonyl compounds, yielding a strong correlation coefficient of. Additionally, inter-correlations among various molecular descriptors were examined to better understand their influence on boiling point behavior.

Zenodo (CERN European Organization for Nuclear Research)
Government of Karnataka (IN), Dr. Hari Singh Gour University (IN)
Openalex Percentile: Top 57%
Computational Drug Discovery Methods
DOIOpen Access PDFOpenAlex
AI Navigator

Ask Laika to Summarize, Analyze, and Connect papers live on the map.

Summarize Papers & Methodologies

Extract key findings, datasets, and comparative methods across publications.

Benchmark Rankings & Visual Analytics

Rank top research institutions, authors, funders, topics, and journals by Field-Weighted Citation Impact (FWCI) and paper volume with instant charts.

Connect Distant Disciplines

Bridge topological clusters on the map to find hidden collaborative intersections.

Investigation of Structure–Boiling Point Correlations of Carbonyl Compounds through Molecular Descriptor Analysis · Zenodo (CERN European Organization for Nuclear Research) (2025) | TGRS Research Map | TGRS