hydrazinecarboxylic acid;(methyldisulfanyl)methane;nickel

C3H10N2NiO2S2 — CID 158861576

IUPAChydrazinecarboxylic acid;(methyldisulfanyl)methane;nickel
SMILESCSSC.NNC(=O)O.[Ni]
InChIInChI=1S/C2H6S2.CH4N2O2.Ni/c1-3-4-2;2-3-1(4)5;/h1-2H3;3H,2H2,(H,4,5);
InChIKeyJASLELIVJFLYJS-UHFFFAOYSA-N
MW228.95 g/mol
LogP0.75
Rot. Bonds1

About hydrazinecarboxylic acid;(methyldisulfanyl)methane;nickel

hydrazinecarboxylic acid;(methyldisulfanyl)methane;nickel (PubChem CID 158861576) has the molecular formula C3H10N2NiO2S2 and a molecular weight of 228.95 g/mol. Its IUPAC name is hydrazinecarboxylic acid;(methyldisulfanyl)methane;nickel.

Molecular Properties

Compound Namehydrazinecarboxylic acid;(methyldisulfanyl)methane;nickel
PubChem CID158861576
Molecular FormulaC3H10N2NiO2S2
Molecular Weight228.95 g/mol
Exact Mass227.95
IUPAC Namehydrazinecarboxylic acid;(methyldisulfanyl)methane;nickel
SMILESCSSC.NNC(=O)O.[Ni]
InChIInChI=1S/C2H6S2.CH4N2O2.Ni/c1-3-4-2;2-3-1(4)5;/h1-2H3;3H,2H2,(H,4,5);
InChIKeyJASLELIVJFLYJS-UHFFFAOYSA-N
XLogP0.75
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.95
LogP ≤ 50.75
H-Bond Donors ≤ 53
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'}

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Related Compounds

Methyldithio carbazate
CID 91065869
(Methylsulfanylamino)carbamic acid
CID 151747670
Hydrazinecarboxylic acid;(methyldisulfanyl)methane;neodymium
CID 159712573
Hydrazinecarboxylic acid;(methyldisulfanyl)methane
CID 174381974
Disulfanylmethane;hydrazinecarboxylic acid
CID 174381975
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 hydrazinecarboxylic acid;(methyldisulfanyl)methane;nickel?
The IUPAC name of hydrazinecarboxylic acid;(methyldisulfanyl)methane;nickel (CID 158861576) is hydrazinecarboxylic acid;(methyldisulfanyl)methane;nickel.
What is the SMILES notation for hydrazinecarboxylic acid;(methyldisulfanyl)methane;nickel?
The canonical SMILES for hydrazinecarboxylic acid;(methyldisulfanyl)methane;nickel is CSSC.NNC(=O)O.[Ni].
What is the InChIKey of hydrazinecarboxylic acid;(methyldisulfanyl)methane;nickel?
The InChIKey is JASLELIVJFLYJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6S2.CH4N2O2.Ni/c1-3-4-2;2-3-1(4)5;/h1-2H3;3H,2H2,(H,4,5);.
What are the key properties of hydrazinecarboxylic acid;(methyldisulfanyl)methane;nickel?
hydrazinecarboxylic acid;(methyldisulfanyl)methane;nickel has a molecular weight of 228.95 g/mol, XLogP of 0.75, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for hydrazinecarboxylic acid;(methyldisulfanyl)methane;nickel is sourced from PubChem (CID 158861576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).