515-42-4,MFCD00065179
Catalog No.:AA003NYA

515-42-4 | Sodium benzenesulfonate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
95%
in stock  
$18.00   $13.00
- +
25g
95%
in stock  
$24.00   $17.00
- +
100g
95%
in stock  
$51.00   $36.00
- +
500g
95%
in stock  
$180.00   $126.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA003NYA
Chemical Name:
Sodium benzenesulfonate
CAS Number:
515-42-4
Molecular Formula:
C6H5NaO3S
Molecular Weight:
180.1569
MDL Number:
MFCD00065179
SMILES:
[O-]S(=O)(=O)c1ccccc1.[Na+]
Properties
Properties
 
Form:
Solid  
MP:
450 °C  
Solubility:
water: soluble  
Stability:
Hygroscopic  
Storage:
Inert atmosphere;Room Temperature;  

Computed Properties
 
Complexity:
188  
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  

Downstream Synthesis Route

[1]MonatsheftefurChemie,1907,vol.28,p.785

[1]TetrahedronLetters,2003,vol.44,p.1499-1501

[2]Patent:KR101522464,2015,B1.Locationinpatent:Paragraph0032;0033

[3]JustusLiebigsAnnalenderChemie,1867,vol.141,p.366

[4]RecueildesTravauxChimiquesdesPays-Bas,1899,vol.18,p.435

[5]ZhurnalObshcheiKhimii,20<1950<1818,1819;engl.Ausg.S.1883,

[6]JournaloftheAmericanChemicalSociety,1924,vol.46,p.170,174

[7]Synthesis,1998,p.423-426

[8]JournalofOrganicChemistry,2008,vol.73,p.3967-3969

[1]Patent:US2607801,1950,

[2]SpectrochimicaActaPartA:MolecularandBiomolecularSpectroscopy,2013,vol.100,p.41-50

[3]ChemicalCommunications,2013,vol.49,p.2365-2367

[1]JournalofOrganicChemistry,1988,vol.53,p.1912-1918

[1]JournalofOrganicChemistry,1989,vol.54,p.5453-5459

Literature
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Additional Info:
SDS
Tags:515-42-4 Molecular Formula|515-42-4 MDL|515-42-4 SMILES|515-42-4 Sodium benzenesulfonate
Catalog No.: AA003NYA
515-42-4,MFCD00065179
515-42-4 | Sodium benzenesulfonate
Pack Size: 5g
Purity: 95%
in stock
$18.00 $13.00
Pack Size: 25g
Purity: 95%
in stock
$24.00 $17.00
Pack Size: 100g
Purity: 95%
in stock
$51.00 $36.00
Pack Size: 500g
Purity: 95%
in stock
$180.00 $126.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA003NYA
Chemical Name: Sodium benzenesulfonate
CAS Number: 515-42-4
Molecular Formula: C6H5NaO3S
Molecular Weight: 180.1569
MDL Number: MFCD00065179
SMILES: [O-]S(=O)(=O)c1ccccc1.[Na+]
Properties
Form: Solid  
MP: 450 °C  
Solubility: water: soluble  
Stability: Hygroscopic  
Storage: Inert atmosphere;Room Temperature;  
Complexity: 188  
Covalently-Bonded Unit Count: 2  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 11  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
Downstream Synthesis Route
64-67-5    515-42-4    515-46-8 

[1]MonatsheftefurChemie,1907,vol.28,p.785

515-42-4    98-09-9 

[1]TetrahedronLetters,2003,vol.44,p.1499-1501

[2]Patent:KR101522464,2015,B1.Locationinpatent:Paragraph0032;0033

[3]JustusLiebigsAnnalenderChemie,1867,vol.141,p.366

[4]RecueildesTravauxChimiquesdesPays-Bas,1899,vol.18,p.435

[5]ZhurnalObshcheiKhimii,20<1950<1818,1819;engl.Ausg.S.1883,

[6]JournaloftheAmericanChemicalSociety,1924,vol.46,p.170,174

[7]Synthesis,1998,p.423-426

[8]JournalofOrganicChemistry,2008,vol.73,p.3967-3969

98-11-3    515-42-4 

[1]Patent:US2607801,1950,

[2]SpectrochimicaActaPartA:MolecularandBiomolecularSpectroscopy,2013,vol.100,p.41-50

[3]ChemicalCommunications,2013,vol.49,p.2365-2367

15365-25-0    515-42-4    113811-59-9 

[1]JournalofOrganicChemistry,1988,vol.53,p.1912-1918

515-42-4    105-36-2    7605-30-3 

[1]JournalofOrganicChemistry,1989,vol.54,p.5453-5459

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