ethane;formaldehyde;methane;methanol;molecular hydrogen;hydroxide;heptahydrate

C15H61O12- — CID 162153094

IUPACethane;formaldehyde;methane;methanol;molecular hydrogen;hydroxide;heptahydrate
SMILESC.C=O.C=O.C=O.CC.CC.CC.CC.CC.CO.O.O.O.O.O.O.O.[H][H].[OH-]
InChIInChI=1S/5C2H6.CH4O.3CH2O.CH4.8H2O.H2/c9*1-2;;;;;;;;;;/h5*1-2H3;2H,1H3;3*1H2;1H4;8*1H2;1H/p-1
InChIKeyZGZDYRIGUWPDLW-UHFFFAOYSA-M
MW433.64 g/mol
LogP-0.88
Rot. Bonds

About ethane;formaldehyde;methane;methanol;molecular hydrogen;hydroxide;heptahydrate

ethane;formaldehyde;methane;methanol;molecular hydrogen;hydroxide;heptahydrate (PubChem CID 162153094) has the molecular formula C15H61O12- and a molecular weight of 433.64 g/mol. Its IUPAC name is ethane;formaldehyde;methane;methanol;molecular hydrogen;hydroxide;heptahydrate.

Molecular Properties

Compound Nameethane;formaldehyde;methane;methanol;molecular hydrogen;hydroxide;heptahydrate
PubChem CID162153094
Molecular FormulaC15H61O12-
Molecular Weight433.64 g/mol
Exact Mass433.42
IUPAC Nameethane;formaldehyde;methane;methanol;molecular hydrogen;hydroxide;heptahydrate
SMILESC.C=O.C=O.C=O.CC.CC.CC.CC.CC.CO.O.O.O.O.O.O.O.[H][H].[OH-]
InChIInChI=1S/5C2H6.CH4O.3CH2O.CH4.8H2O.H2/c9*1-2;;;;;;;;;;/h5*1-2H3;2H,1H3;3*1H2;1H4;8*1H2;1H/p-1
InChIKeyZGZDYRIGUWPDLW-UHFFFAOYSA-M
XLogP-0.88
TPSA321.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500433.64
LogP ≤ 5-0.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze ethane;formaldehyde;methane;methanol;molecular hydrogen;hydroxide;heptahydrate 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

ethane;formaldehyde;hydrate
CID 173433159
ethane;molecular hydrogen;hydrate
CID 143324893
carbanide;formaldehyde;methane;methanol;propan-2-ol;hydrate
CID 159793632
formaldehyde;formic acid;methane;methanol
CID 172740588
ethane;hydrogen peroxide;methane;hydrate
CID 161257433
acetic acid;ethene;molecular hydrogen;dihydrate
CID 158162116
methane;molecular hydrogen;dihydrate
CID 160608799
carbon dioxide;formaldehyde;molecular hydrogen;hydrate
CID 158435907
bis(carbon dioxide);carbon monoxide;methanol;molecular hydrogen;dihydrate
CID 159305063
acetic acid;formaldehyde;hydrate
CID 19350045
CID 102258684
CID 102258684
acetaldehyde;tris(carbon dioxide);ethane;formaldehyde;methane;yttrium;hydrate
CID 161327837

Frequently Asked Questions

What is the IUPAC name of ethane;formaldehyde;methane;methanol;molecular hydrogen;hydroxide;heptahydrate?
The IUPAC name of ethane;formaldehyde;methane;methanol;molecular hydrogen;hydroxide;heptahydrate (CID 162153094) is ethane;formaldehyde;methane;methanol;molecular hydrogen;hydroxide;heptahydrate.
What is the SMILES notation for ethane;formaldehyde;methane;methanol;molecular hydrogen;hydroxide;heptahydrate?
The canonical SMILES for ethane;formaldehyde;methane;methanol;molecular hydrogen;hydroxide;heptahydrate is C.C=O.C=O.C=O.CC.CC.CC.CC.CC.CO.O.O.O.O.O.O.O.[H][H].[OH-].
What is the InChIKey of ethane;formaldehyde;methane;methanol;molecular hydrogen;hydroxide;heptahydrate?
The InChIKey is ZGZDYRIGUWPDLW-UHFFFAOYSA-M. The full InChI is InChI=1S/5C2H6.CH4O.3CH2O.CH4.8H2O.H2/c9*1-2;;;;;;;;;;/h5*1-2H3;2H,1H3;3*1H2;1H4;8*1H2;1H/p-1.
What are the key properties of ethane;formaldehyde;methane;methanol;molecular hydrogen;hydroxide;heptahydrate?
ethane;formaldehyde;methane;methanol;molecular hydrogen;hydroxide;heptahydrate has a molecular weight of 433.64 g/mol, XLogP of -0.88, 0 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;formaldehyde;methane;methanol;molecular hydrogen;hydroxide;heptahydrate is sourced from PubChem (CID 162153094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).