lithium;3-(1-fluoroethyl)-1-benzofuran;hydride

C10H10FLiO — CID 175140613

IUPAClithium;3-(1-fluoroethyl)-1-benzofuran;hydride
SMILESCC(F)c1coc2ccccc12.[H-].[Li+]
InChIInChI=1S/C10H9FO.Li.H/c1-7(11)9-6-12-10-5-3-2-4-8(9)10;;/h2-7H,1H3;;/q;+1;-1
InChIKeyAKHUCFYTDKASIA-UHFFFAOYSA-N
MW172.13 g/mol
LogP0.58
Rot. Bonds1

About lithium;3-(1-fluoroethyl)-1-benzofuran;hydride

lithium;3-(1-fluoroethyl)-1-benzofuran;hydride (PubChem CID 175140613) has the molecular formula C10H10FLiO and a molecular weight of 172.13 g/mol. Its IUPAC name is lithium;3-(1-fluoroethyl)-1-benzofuran;hydride.

Molecular Properties

Compound Namelithium;3-(1-fluoroethyl)-1-benzofuran;hydride
PubChem CID175140613
Molecular FormulaC10H10FLiO
Molecular Weight172.13 g/mol
Exact Mass172.09
IUPAC Namelithium;3-(1-fluoroethyl)-1-benzofuran;hydride
SMILESCC(F)c1coc2ccccc12.[H-].[Li+]
InChIInChI=1S/C10H9FO.Li.H/c1-7(11)9-6-12-10-5-3-2-4-8(9)10;;/h2-7H,1H3;;/q;+1;-1
InChIKeyAKHUCFYTDKASIA-UHFFFAOYSA-N
XLogP0.58
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.13
LogP ≤ 50.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(1-benzofuran-3-yl)-N,N-dimethylethanamine
CID 116914687
2-(1-benzofuran-3-yl)propan-1-ol
CID 23614436
1-(1-benzofuran-3-yl)-2-bromopropan-1-ol
CID 116863408
1-(1-benzofuran-3-yl)-2-methylpentan-1-ol
CID 107892766
1-(1-benzofuran-3-yl)-2,2,2-trifluoro-N-methylethanamine
CID 116961416
2-(1-benzofuran-3-yl)-3-methylbutanenitrile
CID 116964671
2-(aminomethyl)-1-(1-benzofuran-3-yl)-3-methylbutan-1-ol
CID 65185900
3-benzhydryl-1-benzofuran
CID 53493031
1-benzofuran-3-yl(chloro)methanamine
CID 116947842
1-(1-benzofuran-3-yl)-2,2,2-trifluoro-N,N-dimethylethanamine
CID 116914399
1-benzofuran-3-yl(methoxy)methanamine
CID 116947357
1-(1-benzofuran-3-yl)-3-methylbutane-1,4-diamine
CID 116934253

Frequently Asked Questions

What is the IUPAC name of lithium;3-(1-fluoroethyl)-1-benzofuran;hydride?
The IUPAC name of lithium;3-(1-fluoroethyl)-1-benzofuran;hydride (CID 175140613) is lithium;3-(1-fluoroethyl)-1-benzofuran;hydride.
What is the SMILES notation for lithium;3-(1-fluoroethyl)-1-benzofuran;hydride?
The canonical SMILES for lithium;3-(1-fluoroethyl)-1-benzofuran;hydride is CC(F)c1coc2ccccc12.[H-].[Li+].
What is the InChIKey of lithium;3-(1-fluoroethyl)-1-benzofuran;hydride?
The InChIKey is AKHUCFYTDKASIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FO.Li.H/c1-7(11)9-6-12-10-5-3-2-4-8(9)10;;/h2-7H,1H3;;/q;+1;-1.
What are the key properties of lithium;3-(1-fluoroethyl)-1-benzofuran;hydride?
lithium;3-(1-fluoroethyl)-1-benzofuran;hydride has a molecular weight of 172.13 g/mol, XLogP of 0.58, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;3-(1-fluoroethyl)-1-benzofuran;hydride is sourced from PubChem (CID 175140613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).