sodium;2-(2-fluorophenyl)-2-methylpropanoic acid;hydride

C10H12FNaO2 — CID 173208060

IUPACsodium;2-(2-fluorophenyl)-2-methylpropanoic acid;hydride
SMILESCC(C)(C(=O)O)c1ccccc1F.[H-].[Na+]
InChIInChI=1S/C10H11FO2.Na.H/c1-10(2,9(12)13)7-5-3-4-6-8(7)11;;/h3-6H,1-2H3,(H,12,13);;/q;+1;-1
InChIKeyJENSMMAMAPLLMT-UHFFFAOYSA-N
MW206.19 g/mol
LogP-0.70
Rot. Bonds2

About sodium;2-(2-fluorophenyl)-2-methylpropanoic acid;hydride

sodium;2-(2-fluorophenyl)-2-methylpropanoic acid;hydride (PubChem CID 173208060) has the molecular formula C10H12FNaO2 and a molecular weight of 206.19 g/mol. Its IUPAC name is sodium;2-(2-fluorophenyl)-2-methylpropanoic acid;hydride.

Molecular Properties

Compound Namesodium;2-(2-fluorophenyl)-2-methylpropanoic acid;hydride
PubChem CID173208060
Molecular FormulaC10H12FNaO2
Molecular Weight206.19 g/mol
Exact Mass206.07
IUPAC Namesodium;2-(2-fluorophenyl)-2-methylpropanoic acid;hydride
SMILESCC(C)(C(=O)O)c1ccccc1F.[H-].[Na+]
InChIInChI=1S/C10H11FO2.Na.H/c1-10(2,9(12)13)7-5-3-4-6-8(7)11;;/h3-6H,1-2H3,(H,12,13);;/q;+1;-1
InChIKeyJENSMMAMAPLLMT-UHFFFAOYSA-N
XLogP-0.70
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.19
LogP ≤ 5-0.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze sodium;2-(2-fluorophenyl)-2-methylpropanoic acid;hydride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-2-(2-fluorophenyl)-2-hydroxypropanoic acid
CID 55255014
2-(2-fluorophenyl)-N,2-dimethylpropanamide
CID 168736996
2-(2-fluoro-5-methylphenyl)-2-methylpropanoic acid
CID 62394143
2,2-difluoro-2-(2-fluorophenyl)acetic acid
CID 62492425
2-[acetyl(methyl)amino]-2-(2-fluorophenyl)propanoic acid
CID 55232992
2-methyl-2-[2-(1,1,2,2-tetrafluoroethyl)phenyl]propanoic acid
CID 84729711
(3S)-3-amino-3-(2-fluorophenyl)butan-2-one
CID 122592093
2-methyl-2-(2-nitrosophenyl)propanoic acid
CID 130121803
2-methyl-2-[2-(1,2,2-trifluoroethyl)phenyl]propanoic acid
CID 84728614
2-[2-[[2-(2-fluorophenyl)-2-methylpropanoyl]amino]ethylsulfanyl]acetic acid
CID 119242538
magnesium;hydride;2-methyl-2-phenylpropanoic acid
CID 174669783
2-(4-fluoro-1-benzofuran-3-yl)-2-methylpropanoic acid
CID 117119169

Frequently Asked Questions

What is the IUPAC name of sodium;2-(2-fluorophenyl)-2-methylpropanoic acid;hydride?
The IUPAC name of sodium;2-(2-fluorophenyl)-2-methylpropanoic acid;hydride (CID 173208060) is sodium;2-(2-fluorophenyl)-2-methylpropanoic acid;hydride.
What is the SMILES notation for sodium;2-(2-fluorophenyl)-2-methylpropanoic acid;hydride?
The canonical SMILES for sodium;2-(2-fluorophenyl)-2-methylpropanoic acid;hydride is CC(C)(C(=O)O)c1ccccc1F.[H-].[Na+].
What is the InChIKey of sodium;2-(2-fluorophenyl)-2-methylpropanoic acid;hydride?
The InChIKey is JENSMMAMAPLLMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FO2.Na.H/c1-10(2,9(12)13)7-5-3-4-6-8(7)11;;/h3-6H,1-2H3,(H,12,13);;/q;+1;-1.
What are the key properties of sodium;2-(2-fluorophenyl)-2-methylpropanoic acid;hydride?
sodium;2-(2-fluorophenyl)-2-methylpropanoic acid;hydride has a molecular weight of 206.19 g/mol, XLogP of -0.70, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;2-(2-fluorophenyl)-2-methylpropanoic acid;hydride is sourced from PubChem (CID 173208060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).