hydrazine;methyl hydrogen sulfate;hydrate

CH10N2O5S — CID 174768364

IUPAChydrazine;methyl hydrogen sulfate;hydrate
SMILESCOS(=O)(=O)O.NN.O
InChIInChI=1S/CH4O4S.H4N2.H2O/c1-5-6(2,3)4;1-2;/h1H3,(H,2,3,4);1-2H2;1H2
InChIKeyCBXRFEOAVQPVEE-UHFFFAOYSA-N
MW162.17 g/mol
LogP-2.57
Rot. Bonds1

About hydrazine;methyl hydrogen sulfate;hydrate

hydrazine;methyl hydrogen sulfate;hydrate (PubChem CID 174768364) has the molecular formula CH10N2O5S and a molecular weight of 162.17 g/mol. Its IUPAC name is hydrazine;methyl hydrogen sulfate;hydrate.

Molecular Properties

Compound Namehydrazine;methyl hydrogen sulfate;hydrate
PubChem CID174768364
Molecular FormulaCH10N2O5S
Molecular Weight162.17 g/mol
Exact Mass162.03
IUPAC Namehydrazine;methyl hydrogen sulfate;hydrate
SMILESCOS(=O)(=O)O.NN.O
InChIInChI=1S/CH4O4S.H4N2.H2O/c1-5-6(2,3)4;1-2;/h1H3,(H,2,3,4);1-2H2;1H2
InChIKeyCBXRFEOAVQPVEE-UHFFFAOYSA-N
XLogP-2.57
TPSA147.14 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.17
LogP ≤ 5-2.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of hydrazine;methyl hydrogen sulfate;hydrate?
The IUPAC name of hydrazine;methyl hydrogen sulfate;hydrate (CID 174768364) is hydrazine;methyl hydrogen sulfate;hydrate.
What is the SMILES notation for hydrazine;methyl hydrogen sulfate;hydrate?
The canonical SMILES for hydrazine;methyl hydrogen sulfate;hydrate is COS(=O)(=O)O.NN.O.
What is the InChIKey of hydrazine;methyl hydrogen sulfate;hydrate?
The InChIKey is CBXRFEOAVQPVEE-UHFFFAOYSA-N. The full InChI is InChI=1S/CH4O4S.H4N2.H2O/c1-5-6(2,3)4;1-2;/h1H3,(H,2,3,4);1-2H2;1H2.
What are the key properties of hydrazine;methyl hydrogen sulfate;hydrate?
hydrazine;methyl hydrogen sulfate;hydrate has a molecular weight of 162.17 g/mol, XLogP of -2.57, 1 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for hydrazine;methyl hydrogen sulfate;hydrate is sourced from PubChem (CID 174768364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).