CID 153289995

C8H5BiF2O2 — CID 153289995

IUPAC—
SMILESCc1c(F)cc(C(=O)O[Bi])cc1F
InChIInChI=1S/C8H6F2O2.Bi/c1-4-6(9)2-5(8(11)12)3-7(4)10;/h2-3H,1H3,(H,11,12);/q;+1/p-1
InChIKeySFTSJOAVCANBQI-UHFFFAOYSA-M
MW380.10 g/mol
LogP1.51
Rot. Bonds1

About CID 153289995

CID 153289995 (PubChem CID 153289995) has the molecular formula C8H5BiF2O2 and a molecular weight of 380.10 g/mol.

Molecular Properties

Compound NameCID 153289995
PubChem CID153289995
Molecular FormulaC8H5BiF2O2
Molecular Weight380.10 g/mol
Exact Mass380.01
IUPAC Name—
SMILESCc1c(F)cc(C(=O)O[Bi])cc1F
InChIInChI=1S/C8H6F2O2.Bi/c1-4-6(9)2-5(8(11)12)3-7(4)10;/h2-3H,1H3,(H,11,12);/q;+1/p-1
InChIKeySFTSJOAVCANBQI-UHFFFAOYSA-M
XLogP1.51
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.10
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 153289995?
The IUPAC name of CID 153289995 (CID 153289995) is not available.
What is the SMILES notation for CID 153289995?
The canonical SMILES for CID 153289995 is Cc1c(F)cc(C(=O)O[Bi])cc1F.
What is the InChIKey of CID 153289995?
The InChIKey is SFTSJOAVCANBQI-UHFFFAOYSA-M. The full InChI is InChI=1S/C8H6F2O2.Bi/c1-4-6(9)2-5(8(11)12)3-7(4)10;/h2-3H,1H3,(H,11,12);/q;+1/p-1.
What are the key properties of CID 153289995?
CID 153289995 has a molecular weight of 380.10 g/mol, XLogP of 1.51, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 153289995 is sourced from PubChem (CID 153289995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).