CID 170307924

C8H7FNaO2 — CID 170307924

IUPAC—
SMILESCOC(=O)c1ccc(F)cc1.[Na]
InChIInChI=1S/C8H7FO2.Na/c1-11-8(10)6-2-4-7(9)5-3-6;/h2-5H,1H3;
InChIKeyRAKWMIJCWSKSJX-UHFFFAOYSA-N
MW177.13 g/mol
LogP1.23
Rot. Bonds1

About CID 170307924

CID 170307924 (PubChem CID 170307924) has the molecular formula C8H7FNaO2 and a molecular weight of 177.13 g/mol.

Molecular Properties

Compound NameCID 170307924
PubChem CID170307924
Molecular FormulaC8H7FNaO2
Molecular Weight177.13 g/mol
Exact Mass177.03
IUPAC Name—
SMILESCOC(=O)c1ccc(F)cc1.[Na]
InChIInChI=1S/C8H7FO2.Na/c1-11-8(10)6-2-4-7(9)5-3-6;/h2-5H,1H3;
InChIKeyRAKWMIJCWSKSJX-UHFFFAOYSA-N
XLogP1.23
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.13
LogP ≤ 51.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 170307924?
The IUPAC name of CID 170307924 (CID 170307924) is not available.
What is the SMILES notation for CID 170307924?
The canonical SMILES for CID 170307924 is COC(=O)c1ccc(F)cc1.[Na].
What is the InChIKey of CID 170307924?
The InChIKey is RAKWMIJCWSKSJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7FO2.Na/c1-11-8(10)6-2-4-7(9)5-3-6;/h2-5H,1H3;.
What are the key properties of CID 170307924?
CID 170307924 has a molecular weight of 177.13 g/mol, XLogP of 1.23, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 170307924 is sourced from PubChem (CID 170307924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).