Record Information
Version 1.0
Update Date 1/22/2018 11:54:54 AM
Metabolite IDPAMDB005079
Identification
Name: Methane
Description:A one-carbon compound in which the carbon is attached by single bonds to four hydrogen atoms. It is a colourless, odourless, non-toxic but flammable gas (b.p. ??61?C).
Structure
Thumb
Synonyms:
  • Acticarbone
  • Adsorbit
  • Anthrasorb
  • Aquadag
  • Aroflow
  • Arogen
  • Arotone
  • Arovel
  • Arrow
  • Atlantic
  • Biogas
  • Cancarb
  • Canesorb
  • Canlub
  • Carbene
  • Carbodis
  • Carbolac
  • Carbomet
  • Carbone
  • Carbonium
  • Carbono
  • Carbosieve
  • Cecarbon
  • CH4
  • Collocarb
  • Conductex
  • Continex
  • Croflex
  • Crolac
  • Darco
  • Degussa
  • Electrographite
  • Elftex
  • Essex
  • Excelsior
  • Farbruss
  • Fecto
  • Filtrasorb
  • Fire dAMP
  • Flamruss
  • Furnal
  • Furnex
  • Gastex
  • Grafoil
  • Grosafe
  • Huber
  • Humenegro
  • Hydrodarco
  • Kohlenstoff
  • Korobon
  • Kosmink
  • Kosmobil
  • Kosmolak
  • Kosmos
  • Kosmotherm
  • Kosmovar
  • Lampblack
  • Magecol
  • Marsh gas
  • Metanex
  • Metano
  • Methan
  • Methane in gaseus STate
  • Methane in gaseus STic acid
  • Methyl hydride
  • Methylene
  • Methylidyne
  • Micronex
  • Modulex
  • Molacco
  • Neotex
  • Nuchar
  • Papyex
  • Pelletex
  • Philblack
  • Plumbago
  • Printex
  • R 50
  • Rebonex
  • Schungite
  • Sevacarb
  • Shungite
  • Spheron
  • Statex
  • Superba
  • Thermatomic
  • Thermax
  • Thermblack
  • Tinolite
  • Watercarb
Chemical Formula: CH4
Average Molecular Weight: 16.0425
Monoisotopic Molecular Weight: 16.031300128
InChI Key: VNWKTOKETHGBQD-UHFFFAOYSA-N
InChI:InChI=1S/CH4/h1H4
CAS number: 74-82-8
IUPAC Name:methane
Traditional IUPAC Name: methane
SMILES:C
Chemical Taxonomy
Taxonomy DescriptionThis compound belongs to the class of organic compounds known as acyclic alkanes. These are acyclic hydrocarbons consisting only of n carbon atoms and m hydrogen atoms where m=2*n + 2.
Kingdom Organic compounds
Super ClassHydrocarbons
Class Alkanes
Sub ClassAcyclic alkanes
Direct Parent Acyclic alkanes
Alternative Parents Not Available
Substituents
  • Acyclic alkane
  • Aliphatic acyclic compound
Molecular Framework Aliphatic acyclic compounds
External Descriptors
Physical Properties
State: Not Available
Charge:0
Melting point: Not Available
Experimental Properties:
PropertyValueSource
Predicted Properties
PropertyValueSource
logP1.08ChemAxon
Physiological Charge0ChemAxon
Hydrogen Acceptor Count0ChemAxon
Hydrogen Donor Count0ChemAxon
Polar Surface Area0 Å2ChemAxon
Rotatable Bond Count0ChemAxon
Refractivity6.35 m3·mol-1ChemAxon
Polarizability2.59 Å3ChemAxon
Number of Rings0ChemAxon
Bioavailability1ChemAxon
Rule of FiveYesChemAxon
Ghose FilterYesChemAxon
Veber's RuleYesChemAxon
MDDR-like RuleYesChemAxon
Biological Properties
Cellular Locations: Cytoplasm
Reactions:
Pathways:
  • Phosphonate and phosphinate metabolism pae00440
Spectra
Spectra:
Spectrum TypeDescriptionSplash Key
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10V, Positivesplash10-014i-9000000000-9d8342b86bcfe423c16eView in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 20V, Positivesplash10-014i-9000000000-9d8342b86bcfe423c16eView in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 40V, Positivesplash10-014i-9000000000-9d8342b86bcfe423c16eView in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10V, Negativesplash10-014i-9000000000-c888af3d1348fef91ee6View in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 20V, Negativesplash10-014i-9000000000-c888af3d1348fef91ee6View in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 40V, Negativesplash10-014i-9000000000-c888af3d1348fef91ee6View in MoNA
MSMass Spectrum (Electron Ionization)splash10-014i-9000000000-349ab823203cc040e2eeView in MoNA
1D NMR1H NMR SpectrumNot Available
References
References: Not Available
Synthesis Reference: Not Available
Material Safety Data Sheet (MSDS) Not Available
External Links:
ResourceLink
CHEBI ID16183
HMDB IDHMDB02714
Pubchem Compound ID297
Kegg IDC01438
ChemSpider ID291
Wikipedia IDMethane
BioCyc IDNot Available