CID 163929153

H2BO4S2 — CID 163929153

About CID 163929153

CID 163929153 (PubChem CID 163929153) has the molecular formula H2BO4S2 and a molecular weight of 140.96 g/mol.

Molecular Properties

• Compound Name: CID 163929153
• PubChem CID: 163929153
• Molecular Formula: H2BO4S2
• Molecular Weight: 140.96 g/mol
• Exact Mass: 140.95
• IUPAC Name: —
• SMILES: O=S(O)S(=O)O.[B]
• InChI: InChI=1S/B.H2O4S2/c;1-5(2)6(3)4/h;(H,1,2)(H,3,4)
• InChIKey: NAWBPRKXOGJOTQ-UHFFFAOYSA-N
• XLogP: -1.04
• TPSA: 74.60 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 2
• Rotatable Bonds: 1
• Heavy Atoms: 7
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	140.96
LogP ≤ 5	-1.04
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of CID 163929153?

The IUPAC name of CID 163929153 (CID 163929153) is not available.

What is the SMILES notation for CID 163929153?

The canonical SMILES for CID 163929153 is O=S(O)S(=O)O.[B].

What is the InChIKey of CID 163929153?

The InChIKey is NAWBPRKXOGJOTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/B.H2O4S2/c;1-5(2)6(3)4/h;(H,1,2)(H,3,4).

What are the key properties of CID 163929153?

CID 163929153 has a molecular weight of 140.96 g/mol, XLogP of -1.04, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for CID 163929153 is sourced from PubChem (CID 163929153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).