Sulfuric Acid, Sodium Salt

CAS: 15124-09-1 · H2NaO4S

2D Structure

3D Structure

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Basic Information

CAS Registry Number: 15124-09-1
Molecular Formula: H2NaO4S
Molecular Mass: 121.07 g/mol

Identifiers

CAS Registry Number

15124-09-1

SMILES

O=S(=O)(O)O.[Na]

InChI Key

PANBYUAFMMOFOV-UHFFFAOYSA-N

InChI

InChI=1S/Na.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)

Names and Synonyms

Sulfuric Acid, Sodium Salt Synonym
Sulfuric acid, sodium salt Synonym

All Properties

Comprehensive physical and chemical properties

Property	Value	Source
Molecular Mass	121.07 g/mol	CAS Common Chemistry
	121.06899999999997 g/mol	RDKit
	121.069 g/mol	RDKit
	122.07 g/mol	chempirical lib
Canonical SMILES	[Na].O=S(=O)(O)O	CAS Common Chemistry
InChI	InChI=1S/Na.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)	CAS Common Chemistry
InChI Key	InChIKey=PANBYUAFMMOFOV-UHFFFAOYSA-N	CAS Common Chemistry
Name	Sulfuric acid, sodium salt	CAS Common Chemistry
Heavy Atom Count	6	RDKit
Hydrogen Bond Acceptors	2	RDKit
Hydrogen Bond Donors	2	RDKit
Rotatable Bonds	0	RDKit
Aromatic Ring Count	0	RDKit
Topological Polar Surface Area	74.60000000000001 Å²	RDKit
	74.6 Å²	RDKit
LogP	-1.0335999999999999	RDKit
	-1.0336	RDKit
Molar Refractivity	19.9314 cm³/mol	RDKit
Ring Count	0	RDKit
Formal Charge	0	RDKit
Fraction Csp3	0.0	RDKit
Exact Mass	120.95714882400001 g/mol	RDKit

Spectral Data

NMR, IR, and Mass spectral data

Predicting NMR spectra...

10 ppm 9 8 7 6 5 4 3 2 1 0 ppm

Shift (ppm)	Multiplicity	Integration	Assignment

200 ppm 180 160 140 120 100 80 60 40 20 0 ppm

Shift (ppm)	DEPT	Assignment

Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.

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MW = 121.07 g/mol. Edit any field — others recompute live.

Mass (g) Moles (mmol) Moles (mol)

Related molecules

Other compounds with formula H2NaO4S.

Sodium Bisulfate CAS 7681-38-1