sodium;hydride;2-phenylmethoxyacetic acid

C9H11NaO3 — CID 174345523

IUPACsodium;hydride;2-phenylmethoxyacetic acid
SMILESO=C(O)COCc1ccccc1.[H-].[Na+]
InChIInChI=1S/C9H10O3.Na.H/c10-9(11)7-12-6-8-4-2-1-3-5-8;;/h1-5H,6-7H2,(H,10,11);;/q;+1;-1
InChIKeyXRXCOHIKRJQTBQ-UHFFFAOYSA-N
MW190.17 g/mol
LogP-1.60
Rot. Bonds4

About sodium;hydride;2-phenylmethoxyacetic acid

sodium;hydride;2-phenylmethoxyacetic acid (PubChem CID 174345523) has the molecular formula C9H11NaO3 and a molecular weight of 190.17 g/mol. Its IUPAC name is sodium;hydride;2-phenylmethoxyacetic acid.

Molecular Properties

Compound Namesodium;hydride;2-phenylmethoxyacetic acid
PubChem CID174345523
Molecular FormulaC9H11NaO3
Molecular Weight190.17 g/mol
Exact Mass190.06
IUPAC Namesodium;hydride;2-phenylmethoxyacetic acid
SMILESO=C(O)COCc1ccccc1.[H-].[Na+]
InChIInChI=1S/C9H10O3.Na.H/c10-9(11)7-12-6-8-4-2-1-3-5-8;;/h1-5H,6-7H2,(H,10,11);;/q;+1;-1
InChIKeyXRXCOHIKRJQTBQ-UHFFFAOYSA-N
XLogP-1.60
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.17
LogP ≤ 5-1.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[4-(hydroxymethyl)phenyl]methoxy]acetic acid
CID 96559713
2-[2-(carboxymethoxy)ethoxy]acetic acid;2-[2-(2-oxo-2-phenylmethoxyethoxy)ethoxy]acetic acid
CID 158939829
acetic acid;phenylmethoxymethylbenzene
CID 175214238
3-methyl-1-phenylmethoxybutan-2-one
CID 22953611
1-chloro-4-phenylmethoxybutane-2,3-dione
CID 87706836
2-[[4-(trifluoromethyl)phenyl]methoxy]acetic acid
CID 69381817
N-phenyl-2-phenylmethoxyacetamide
CID 15220156
3-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethoxy]propanoic acid
CID 14462373
3-[2-(2-phenylmethoxyethoxy)ethoxy]propanoic acid
CID 14462372
1-(methylamino)-3-phenylmethoxypropan-2-one
CID 143048834
methyl 3-oxo-4-phenylmethoxybutanoate
CID 12768799
CID 66734377
CID 66734377

Frequently Asked Questions

What is the IUPAC name of sodium;hydride;2-phenylmethoxyacetic acid?
The IUPAC name of sodium;hydride;2-phenylmethoxyacetic acid (CID 174345523) is sodium;hydride;2-phenylmethoxyacetic acid.
What is the SMILES notation for sodium;hydride;2-phenylmethoxyacetic acid?
The canonical SMILES for sodium;hydride;2-phenylmethoxyacetic acid is O=C(O)COCc1ccccc1.[H-].[Na+].
What is the InChIKey of sodium;hydride;2-phenylmethoxyacetic acid?
The InChIKey is XRXCOHIKRJQTBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10O3.Na.H/c10-9(11)7-12-6-8-4-2-1-3-5-8;;/h1-5H,6-7H2,(H,10,11);;/q;+1;-1.
What are the key properties of sodium;hydride;2-phenylmethoxyacetic acid?
sodium;hydride;2-phenylmethoxyacetic acid has a molecular weight of 190.17 g/mol, XLogP of -1.60, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;hydride;2-phenylmethoxyacetic acid is sourced from PubChem (CID 174345523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).