Metabolite Carbon dioxide

Name
Carbon dioxide
HMDB ID
HMDB01967
Description
Not Available
Structure
Thumb
CAS number
Not Available
Weight
Average: 44.0095
Monoisotopic: 43.989829244
Chemical Formula
CO2
InChI Key
CURLTUGMZLYLDI-UHFFFAOYSA-N
InChI
InChI=1S/CO2/c2-1-3
IUPAC Name
methanedione
SMILES
O=C=O
Reactions
Predicted Properties
PropertyValueSource
Water Solubility186.0 mg/mLALOGPS
logP-0.63ALOGPS
logP-0.28ChemAxon
logS0.63ALOGPS
Physiological Charge0ChemAxon
Hydrogen Acceptor Count2ChemAxon
Hydrogen Donor Count0ChemAxon
Polar Surface Area34.14 Å2ChemAxon
Rotatable Bond Count0ChemAxon
Refractivity6.38 m3·mol-1ChemAxon
Polarizability2.57 Å3ChemAxon
Number of Rings0ChemAxon
Bioavailability1ChemAxon
Rule of FiveYesChemAxon
Ghose FilterNoChemAxon
Veber's RuleYesChemAxon
MDDR-like RuleNoChemAxon