CID 160559897

C6H9BiNO6 — CID 160559897

IUPAC—
SMILESO=C(O)CN(CC(=O)O)CC(=O)O.[Bi]
InChIInChI=1S/C6H9NO6.Bi/c8-4(9)1-7(2-5(10)11)3-6(12)13;/h1-3H2,(H,8,9)(H,10,11)(H,12,13);
InChIKeyQZDZTNJHTLEKPB-UHFFFAOYSA-N
MW400.12 g/mol
LogP-1.84
Rot. Bonds6

About CID 160559897

CID 160559897 (PubChem CID 160559897) has the molecular formula C6H9BiNO6 and a molecular weight of 400.12 g/mol.

Molecular Properties

Compound NameCID 160559897
PubChem CID160559897
Molecular FormulaC6H9BiNO6
Molecular Weight400.12 g/mol
Exact Mass400.02
IUPAC Name—
SMILESO=C(O)CN(CC(=O)O)CC(=O)O.[Bi]
InChIInChI=1S/C6H9NO6.Bi/c8-4(9)1-7(2-5(10)11)3-6(12)13;/h1-3H2,(H,8,9)(H,10,11)(H,12,13);
InChIKeyQZDZTNJHTLEKPB-UHFFFAOYSA-N
XLogP-1.84
TPSA115.14 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.12
LogP ≤ 5-1.84
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 173034412
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CID 87646403
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Frequently Asked Questions

What is the IUPAC name of CID 160559897?
The IUPAC name of CID 160559897 (CID 160559897) is not available.
What is the SMILES notation for CID 160559897?
The canonical SMILES for CID 160559897 is O=C(O)CN(CC(=O)O)CC(=O)O.[Bi].
What is the InChIKey of CID 160559897?
The InChIKey is QZDZTNJHTLEKPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO6.Bi/c8-4(9)1-7(2-5(10)11)3-6(12)13;/h1-3H2,(H,8,9)(H,10,11)(H,12,13);.
What are the key properties of CID 160559897?
CID 160559897 has a molecular weight of 400.12 g/mol, XLogP of -1.84, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 160559897 is sourced from PubChem (CID 160559897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).