formic acid;molecular hydrogen

CH4O2 — CID 173035635

IUPACformic acid;molecular hydrogen
SMILESO=CO.[H][H]
InChIInChI=1S/CH2O2.H2/c2-1-3;/h1H,(H,2,3);1H
InChIKeyGSQVNNUFCPJTPS-UHFFFAOYSA-N
MW48.04 g/mol
LogP-0.05
Rot. Bonds

About formic acid;molecular hydrogen

formic acid;molecular hydrogen (PubChem CID 173035635) has the molecular formula CH4O2 and a molecular weight of 48.04 g/mol. Its IUPAC name is formic acid;molecular hydrogen.

Molecular Properties

Compound Nameformic acid;molecular hydrogen
PubChem CID173035635
Molecular FormulaCH4O2
Molecular Weight48.04 g/mol
Exact Mass48.02
IUPAC Nameformic acid;molecular hydrogen
SMILESO=CO.[H][H]
InChIInChI=1S/CH2O2.H2/c2-1-3;/h1H,(H,2,3);1H
InChIKeyGSQVNNUFCPJTPS-UHFFFAOYSA-N
XLogP-0.05
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms3
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50048.04
LogP ≤ 5-0.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of formic acid;molecular hydrogen?
The IUPAC name of formic acid;molecular hydrogen (CID 173035635) is formic acid;molecular hydrogen.
What is the SMILES notation for formic acid;molecular hydrogen?
The canonical SMILES for formic acid;molecular hydrogen is O=CO.[H][H].
What is the InChIKey of formic acid;molecular hydrogen?
The InChIKey is GSQVNNUFCPJTPS-UHFFFAOYSA-N. The full InChI is InChI=1S/CH2O2.H2/c2-1-3;/h1H,(H,2,3);1H.
What are the key properties of formic acid;molecular hydrogen?
formic acid;molecular hydrogen has a molecular weight of 48.04 g/mol, XLogP of -0.05, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for formic acid;molecular hydrogen is sourced from PubChem (CID 173035635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).