CID 161332384

H5NO4S2 — CID 161332384

IUPAC—
SMILESN.O=S(O)S(=O)O
InChIInChI=1S/H3N.H2O4S2/c;1-5(2)6(3)4/h1H3;(H,1,2)(H,3,4)
InChIKeyVLPAJOJSLDCWAB-UHFFFAOYSA-N
MW147.18 g/mol
LogP-0.49
Rot. Bonds1

About CID 161332384

CID 161332384 (PubChem CID 161332384) has the molecular formula H5NO4S2 and a molecular weight of 147.18 g/mol.

Molecular Properties

Compound NameCID 161332384
PubChem CID161332384
Molecular FormulaH5NO4S2
Molecular Weight147.18 g/mol
Exact Mass146.97
IUPAC Name—
SMILESN.O=S(O)S(=O)O
InChIInChI=1S/H3N.H2O4S2/c;1-5(2)6(3)4/h1H3;(H,1,2)(H,3,4)
InChIKeyVLPAJOJSLDCWAB-UHFFFAOYSA-N
XLogP-0.49
TPSA109.60 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.18
LogP ≤ 5-0.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

CID 86742114
CID 86742114
CID 163929153
CID 163929153
azane;sulfurous acid;dihydrate
CID 172742150
azane;sulfurous acid;trihydrate
CID 173299945
CID 158095964
CID 158095964
sodium;azane;hydrogen sulfite
CID 173222991
disodium;azane;hydride;iron;sulfurous acid
CID 173314683
phosphane;sulfurous acid
CID 173229936
CID 162004424
CID 162004424
hydron;sulfurous acid
CID 173020149
CID 139595971
CID 139595971
iron;sulfurous acid
CID 175438968

Frequently Asked Questions

What is the IUPAC name of CID 161332384?
The IUPAC name of CID 161332384 (CID 161332384) is not available.
What is the SMILES notation for CID 161332384?
The canonical SMILES for CID 161332384 is N.O=S(O)S(=O)O.
What is the InChIKey of CID 161332384?
The InChIKey is VLPAJOJSLDCWAB-UHFFFAOYSA-N. The full InChI is InChI=1S/H3N.H2O4S2/c;1-5(2)6(3)4/h1H3;(H,1,2)(H,3,4).
What are the key properties of CID 161332384?
CID 161332384 has a molecular weight of 147.18 g/mol, XLogP of -0.49, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 161332384 is sourced from PubChem (CID 161332384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).