CID 157249645

C11H10FGaNO — CID 157249645

IUPAC—
SMILESFCCc1ccc2cccc(O[GaH])c2n1
InChIInChI=1S/C11H10FNO.Ga.H/c12-7-6-9-5-4-8-2-1-3-10(14)11(8)13-9;;/h1-5,14H,6-7H2;;/q;+1;/p-1
InChIKeyMKXKKMJRTAQWIB-UHFFFAOYSA-M
MW260.93 g/mol
LogP1.94
Rot. Bonds3

About CID 157249645

CID 157249645 (PubChem CID 157249645) has the molecular formula C11H10FGaNO and a molecular weight of 260.93 g/mol.

Molecular Properties

Compound NameCID 157249645
PubChem CID157249645
Molecular FormulaC11H10FGaNO
Molecular Weight260.93 g/mol
Exact Mass260.00
IUPAC Name—
SMILESFCCc1ccc2cccc(O[GaH])c2n1
InChIInChI=1S/C11H10FNO.Ga.H/c12-7-6-9-5-4-8-2-1-3-10(14)11(8)13-9;;/h1-5,14H,6-7H2;;/q;+1;/p-1
InChIKeyMKXKKMJRTAQWIB-UHFFFAOYSA-M
XLogP1.94
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.93
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 157249645?
The IUPAC name of CID 157249645 (CID 157249645) is not available.
What is the SMILES notation for CID 157249645?
The canonical SMILES for CID 157249645 is FCCc1ccc2cccc(O[GaH])c2n1.
What is the InChIKey of CID 157249645?
The InChIKey is MKXKKMJRTAQWIB-UHFFFAOYSA-M. The full InChI is InChI=1S/C11H10FNO.Ga.H/c12-7-6-9-5-4-8-2-1-3-10(14)11(8)13-9;;/h1-5,14H,6-7H2;;/q;+1;/p-1.
What are the key properties of CID 157249645?
CID 157249645 has a molecular weight of 260.93 g/mol, XLogP of 1.94, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 157249645 is sourced from PubChem (CID 157249645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).