CID 174373472

C7H4BiClO3 — CID 174373472

IUPAC—
SMILESClc1ccc([Bi+2])cc1.O=C([O-])[O-]
InChIInChI=1S/C6H4Cl.CH2O3.Bi/c7-6-4-2-1-3-5-6;2-1(3)4;/h2-5H;(H2,2,3,4);/q;;+2/p-2
InChIKeyPEKRMXYNCGHLIH-UHFFFAOYSA-L
MW380.54 g/mol
LogP-1.31
Rot. Bonds

About CID 174373472

CID 174373472 (PubChem CID 174373472) has the molecular formula C7H4BiClO3 and a molecular weight of 380.54 g/mol.

Molecular Properties

Compound NameCID 174373472
PubChem CID174373472
Molecular FormulaC7H4BiClO3
Molecular Weight380.54 g/mol
Exact Mass379.97
IUPAC Name—
SMILESClc1ccc([Bi+2])cc1.O=C([O-])[O-]
InChIInChI=1S/C6H4Cl.CH2O3.Bi/c7-6-4-2-1-3-5-6;2-1(3)4;/h2-5H;(H2,2,3,4);/q;;+2/p-2
InChIKeyPEKRMXYNCGHLIH-UHFFFAOYSA-L
XLogP-1.31
TPSA63.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.54
LogP ≤ 5-1.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 174373472?
The IUPAC name of CID 174373472 (CID 174373472) is not available.
What is the SMILES notation for CID 174373472?
The canonical SMILES for CID 174373472 is Clc1ccc([Bi+2])cc1.O=C([O-])[O-].
What is the InChIKey of CID 174373472?
The InChIKey is PEKRMXYNCGHLIH-UHFFFAOYSA-L. The full InChI is InChI=1S/C6H4Cl.CH2O3.Bi/c7-6-4-2-1-3-5-6;2-1(3)4;/h2-5H;(H2,2,3,4);/q;;+2/p-2.
What are the key properties of CID 174373472?
CID 174373472 has a molecular weight of 380.54 g/mol, XLogP of -1.31, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 174373472 is sourced from PubChem (CID 174373472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).