Acetylene

This drug entry is a stub and has not been fully annotated. It is scheduled to be annotated soon.

Identification

Summary

Acetylene is a component of a medical gas indicated for lung function testing.

Generic Name
Acetylene
DrugBank Accession Number
DB15906
Background

Not Available

Type
Small Molecule
Groups
Approved, Experimental
Structure
Weight
Average: 26.038
Monoisotopic: 26.015650064
Chemical Formula
C2H2
Synonyms
  • Ethine
  • Ethyne
External IDs
  • 200-816-9

Pharmacology

Indication

Not Available

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Pharmacodynamics

Not Available

Mechanism of action
Not Available
Absorption

Not Available

Volume of distribution

Not Available

Protein binding

Not Available

Metabolism
Not Available
Route of elimination

Not Available

Half-life

Not Available

Clearance

Not Available

Adverse Effects
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Toxicity

Not Available

Pathways
Not Available
Pharmacogenomic Effects/ADRs
Not Available

Interactions

Drug Interactions
This information should not be interpreted without the help of a healthcare provider. If you believe you are experiencing an interaction, contact a healthcare provider immediately. The absence of an interaction does not necessarily mean no interactions exist.
Not Available
Food Interactions
Not Available

Products

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Mixture Products
NameIngredientsDosageRouteLabellerMarketing StartMarketing EndRegionImage
iCOmas 0,3 % / 0,3 % / 0,3 % Gas zur medizinischen Anwendung, druckverdichtetAcetylene (0.3 %) + Carbon monoxide (0.3 %) + Methane (0.3 %)GasRespiratory (inhalation)Linde Sverige Ab2018-07-05Not applicableAustria flag
Lung Diffusion Test MixtureAcetylene (.6 %) + Carbon monoxide (1.5 %) + Neon (1 %) + Nitrogen (81.7 %) + Oxygen (23 %)GasRespiratory (inhalation)Matheson Gas Products Canada Inc.1982-12-311997-12-24Canada flag
Lung Diffusion Test MixtureAcetylene (.5 %) + Carbon dioxide (.4 %) + Medical air (98.6 %) + Neon (.5 %)GasRespiratory (inhalation)Matheson Gas Products Canada Inc.1961-12-311997-12-24Canada flag

Categories

Drug Categories
Classification
Not classified
Affected organisms
Not Available

Chemical Identifiers

UNII
OC7TV75O83
CAS number
74-86-2
InChI Key
HSFWRNGVRCDJHI-UHFFFAOYSA-N
InChI
InChI=1S/C2H2/c1-2/h1-2H
IUPAC Name
acetylene
SMILES
C#C

References

General References
  1. BASG: iCOmas (Acetylene, Carbon Monoxide, Methane) Inhalation Gas [Link]
KEGG Compound
C01548
ChemSpider
6086
RxNav
200
ChEBI
27518
ChEMBL
CHEMBL116336
PDBe Ligand
C2H
Wikipedia
Acetylene
PDB Entries
6bbl

Clinical Trials

Clinical Trials
PhaseStatusPurposeConditionsCount

Pharmacoeconomics

Manufacturers
Not Available
Packagers
Not Available
Dosage Forms
FormRouteStrength
GasRespiratory (inhalation)
Prices
Not Available
Patents
Not Available

Properties

State
Not Available
Experimental Properties
Not Available
Predicted Properties
PropertyValueSource
Water Solubility0.582 mg/mLALOGPS
logP-0.03ALOGPS
logP0.15Chemaxon
logS-1.6ALOGPS
Physiological Charge0Chemaxon
Hydrogen Acceptor Count0Chemaxon
Hydrogen Donor Count0Chemaxon
Polar Surface Area0 Å2Chemaxon
Rotatable Bond Count0Chemaxon
Refractivity8.57 m3·mol-1Chemaxon
Polarizability2.88 Å3Chemaxon
Number of Rings0Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterNoChemaxon
Veber's RuleYesChemaxon
MDDR-like RuleNoChemaxon
Predicted ADMET Features
Not Available

Spectra

Mass Spec (NIST)
Not Available
Spectra
SpectrumSpectrum TypeSplash Key
Predicted MS/MS Spectrum - 10V, Positive (Annotated)Predicted LC-MS/MSsplash10-004i-9000000000-82e1caa378007833f6c3
Predicted MS/MS Spectrum - 10V, Negative (Annotated)Predicted LC-MS/MSsplash10-004i-9000000000-abb04b5310180173b051
Predicted MS/MS Spectrum - 20V, Positive (Annotated)Predicted LC-MS/MSsplash10-004i-9000000000-82e1caa378007833f6c3
Predicted MS/MS Spectrum - 20V, Negative (Annotated)Predicted LC-MS/MSsplash10-004i-9000000000-abb04b5310180173b051
Predicted MS/MS Spectrum - 40V, Positive (Annotated)Predicted LC-MS/MSsplash10-004i-9000000000-82e1caa378007833f6c3
Predicted MS/MS Spectrum - 40V, Negative (Annotated)Predicted LC-MS/MSsplash10-004i-9000000000-abb04b5310180173b051
Predicted 1H NMR Spectrum1D NMRNot Applicable
Predicted 13C NMR Spectrum1D NMRNot Applicable
Chromatographic Properties
Collision Cross Sections (CCS)
AdductCCS Value (Å2)Source typeSource
[M-H]-110.681656
predicted
DeepCCS 1.0 (2019)
[M+H]+112.43892
predicted
DeepCCS 1.0 (2019)
[M+Na]+119.469986
predicted
DeepCCS 1.0 (2019)

Drug created at November 20, 2020 17:27 / Updated at May 07, 2021 21:08