disulfanylmethane;hydrazinecarboxylic acid

C2H8N2O2S2 — CID 174381975

IUPACdisulfanylmethane;hydrazinecarboxylic acid
SMILESCSS.NNC(=O)O
InChIInChI=1S/CH4N2O2.CH4S2/c2-3-1(4)5;1-3-2/h3H,2H2,(H,4,5);2H,1H3
InChIKeyWFHJJISEKNPTES-UHFFFAOYSA-N
MW156.23 g/mol
LogP0.32
Rot. Bonds

About disulfanylmethane;hydrazinecarboxylic acid

disulfanylmethane;hydrazinecarboxylic acid (PubChem CID 174381975) has the molecular formula C2H8N2O2S2 and a molecular weight of 156.23 g/mol. Its IUPAC name is disulfanylmethane;hydrazinecarboxylic acid.

Molecular Properties

Compound Namedisulfanylmethane;hydrazinecarboxylic acid
PubChem CID174381975
Molecular FormulaC2H8N2O2S2
Molecular Weight156.23 g/mol
Exact Mass156.00
IUPAC Namedisulfanylmethane;hydrazinecarboxylic acid
SMILESCSS.NNC(=O)O
InChIInChI=1S/CH4N2O2.CH4S2/c2-3-1(4)5;1-3-2/h3H,2H2,(H,4,5);2H,1H3
InChIKeyWFHJJISEKNPTES-UHFFFAOYSA-N
XLogP0.32
TPSA75.35 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.32
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'disulphide', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Related Compounds

Methyldithio carbazate
CID 91065869
(Methylsulfanylamino)carbamic acid
CID 151747670
Hydrazinecarboxylic acid;(methyldisulfanyl)methane;nickel
CID 158861576
Hydrazinecarboxylic acid;(methyldisulfanyl)methane;neodymium
CID 159712573
Hydrazinecarboxylic acid;(methyldisulfanyl)methane
CID 174381974
Hydrazinecarboxylic acid;(methyldisulfanyl)methane;stibane
CID 174393115
Sodium;hydrazinecarboxylic acid;hydride;(methyldisulfanyl)methane
CID 174394473
Sodium;disulfanylmethane;hydrazinecarboxylic acid;hydride
CID 174394474
Hydrazinecarboxylic acid;(methyldisulfanyl)methane;ZINC
CID 174406776
Disulfanylmethane;hydrazinecarboxylic acid;ZINC
CID 174406777
Hydrazinecarboxylic acid;(methyldisulfanyl)methane;selane
CID 174438476
Hydrazinecarboxylic acid;methylsulfanylmethane;nickel
CID 174573115

Frequently Asked Questions

What is the IUPAC name of disulfanylmethane;hydrazinecarboxylic acid?
The IUPAC name of disulfanylmethane;hydrazinecarboxylic acid (CID 174381975) is disulfanylmethane;hydrazinecarboxylic acid.
What is the SMILES notation for disulfanylmethane;hydrazinecarboxylic acid?
The canonical SMILES for disulfanylmethane;hydrazinecarboxylic acid is CSS.NNC(=O)O.
What is the InChIKey of disulfanylmethane;hydrazinecarboxylic acid?
The InChIKey is WFHJJISEKNPTES-UHFFFAOYSA-N. The full InChI is InChI=1S/CH4N2O2.CH4S2/c2-3-1(4)5;1-3-2/h3H,2H2,(H,4,5);2H,1H3.
What are the key properties of disulfanylmethane;hydrazinecarboxylic acid?
disulfanylmethane;hydrazinecarboxylic acid has a molecular weight of 156.23 g/mol, XLogP of 0.32, 0 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for disulfanylmethane;hydrazinecarboxylic acid is sourced from PubChem (CID 174381975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).