sodium;hydride;phenyl aminomethanesulfinate

C7H10NNaO2S — CID 174802151

IUPACsodium;hydride;phenyl aminomethanesulfinate
SMILESNCS(=O)Oc1ccccc1.[H-].[Na+]
InChIInChI=1S/C7H9NO2S.Na.H/c8-6-11(9)10-7-4-2-1-3-5-7;;/h1-5H,6,8H2;;/q;+1;-1
InChIKeyZQDXHTRBMZFYOA-UHFFFAOYSA-N
MW195.22 g/mol
LogP-2.24
Rot. Bonds3

About sodium;hydride;phenyl aminomethanesulfinate

sodium;hydride;phenyl aminomethanesulfinate (PubChem CID 174802151) has the molecular formula C7H10NNaO2S and a molecular weight of 195.22 g/mol. Its IUPAC name is sodium;hydride;phenyl aminomethanesulfinate.

Molecular Properties

Compound Namesodium;hydride;phenyl aminomethanesulfinate
PubChem CID174802151
Molecular FormulaC7H10NNaO2S
Molecular Weight195.22 g/mol
Exact Mass195.03
IUPAC Namesodium;hydride;phenyl aminomethanesulfinate
SMILESNCS(=O)Oc1ccccc1.[H-].[Na+]
InChIInChI=1S/C7H9NO2S.Na.H/c8-6-11(9)10-7-4-2-1-3-5-7;;/h1-5H,6,8H2;;/q;+1;-1
InChIKeyZQDXHTRBMZFYOA-UHFFFAOYSA-N
XLogP-2.24
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 5-2.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 91127696
phenyl phenylmethanesulfinate
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sodium;hydride;phenyl hydrogen sulfite
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sodium phenyl sulfite
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phenyl benzenesulfonylmethanesulfinate
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sodium;hydride;phenyl 2-methylpropane-2-sulfinate
CID 174955645
phenoxysulfinyl 2-aminoacetate
CID 174683728
phenyl sulfite
CID 14972829
potassium phenyl sulfite
CID 162337240
phenylperoxymethanamine
CID 163956445
ethenyl phenyl sulfite
CID 151720739

Frequently Asked Questions

What is the IUPAC name of sodium;hydride;phenyl aminomethanesulfinate?
The IUPAC name of sodium;hydride;phenyl aminomethanesulfinate (CID 174802151) is sodium;hydride;phenyl aminomethanesulfinate.
What is the SMILES notation for sodium;hydride;phenyl aminomethanesulfinate?
The canonical SMILES for sodium;hydride;phenyl aminomethanesulfinate is NCS(=O)Oc1ccccc1.[H-].[Na+].
What is the InChIKey of sodium;hydride;phenyl aminomethanesulfinate?
The InChIKey is ZQDXHTRBMZFYOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9NO2S.Na.H/c8-6-11(9)10-7-4-2-1-3-5-7;;/h1-5H,6,8H2;;/q;+1;-1.
What are the key properties of sodium;hydride;phenyl aminomethanesulfinate?
sodium;hydride;phenyl aminomethanesulfinate has a molecular weight of 195.22 g/mol, XLogP of -2.24, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;hydride;phenyl aminomethanesulfinate is sourced from PubChem (CID 174802151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).