formaldehyde;sulfuric acid;pentahydrate

CH16O14S2 — CID 174944558

IUPACformaldehyde;sulfuric acid;pentahydrate
SMILESC=O.O.O.O.O.O.O=S(=O)(O)O.O=S(=O)(O)O
InChIInChI=1S/CH2O.2H2O4S.5H2O/c1-2;2*1-5(2,3)4;;;;;/h1H2;2*(H2,1,2,3,4);5*1H2
InChIKeyALOXXGREDZOMGI-UHFFFAOYSA-N
MW316.26 g/mol
LogP-5.61
Rot. Bonds

About formaldehyde;sulfuric acid;pentahydrate

formaldehyde;sulfuric acid;pentahydrate (PubChem CID 174944558) has the molecular formula CH16O14S2 and a molecular weight of 316.26 g/mol. Its IUPAC name is formaldehyde;sulfuric acid;pentahydrate.

Molecular Properties

Compound Nameformaldehyde;sulfuric acid;pentahydrate
PubChem CID174944558
Molecular FormulaCH16O14S2
Molecular Weight316.26 g/mol
Exact Mass316.00
IUPAC Nameformaldehyde;sulfuric acid;pentahydrate
SMILESC=O.O.O.O.O.O.O=S(=O)(O)O.O=S(=O)(O)O
InChIInChI=1S/CH2O.2H2O4S.5H2O/c1-2;2*1-5(2,3)4;;;;;/h1H2;2*(H2,1,2,3,4);5*1H2
InChIKeyALOXXGREDZOMGI-UHFFFAOYSA-N
XLogP-5.61
TPSA323.77 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.26
LogP ≤ 5-5.61
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

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Related Compounds

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CID 174954580
sulfuric acid;tridecahydrate
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CID 175526604
sulfuric acid;vanadium;hexahydrate
CID 174048593
alumane;sulfuric acid;hexahydrate
CID 174932074
methane;sulfuric acid;hydrate
CID 174518914
chromium;sulfuric acid;hydrate
CID 174869270
bis(scandium);sulfuric acid;octahydrate
CID 86222721
ethene;sulfuric acid
CID 88750210
platinum;sulfuric acid;tetrahydrate
CID 131883452
chromium;sulfuric acid;tetrahydrate
CID 173200783
cerium;sulfuric acid;nonahydrate
CID 173422966

Frequently Asked Questions

What is the IUPAC name of formaldehyde;sulfuric acid;pentahydrate?
The IUPAC name of formaldehyde;sulfuric acid;pentahydrate (CID 174944558) is formaldehyde;sulfuric acid;pentahydrate.
What is the SMILES notation for formaldehyde;sulfuric acid;pentahydrate?
The canonical SMILES for formaldehyde;sulfuric acid;pentahydrate is C=O.O.O.O.O.O.O=S(=O)(O)O.O=S(=O)(O)O.
What is the InChIKey of formaldehyde;sulfuric acid;pentahydrate?
The InChIKey is ALOXXGREDZOMGI-UHFFFAOYSA-N. The full InChI is InChI=1S/CH2O.2H2O4S.5H2O/c1-2;2*1-5(2,3)4;;;;;/h1H2;2*(H2,1,2,3,4);5*1H2.
What are the key properties of formaldehyde;sulfuric acid;pentahydrate?
formaldehyde;sulfuric acid;pentahydrate has a molecular weight of 316.26 g/mol, XLogP of -5.61, 0 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for formaldehyde;sulfuric acid;pentahydrate is sourced from PubChem (CID 174944558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).