Home Sulfos Ammonium 2-(ethoxycarbonyl)benzene-1-sulfonate

Ammonium 2-(ethoxycarbonyl)benzene-1-sulfonate

CAS No.:
164078-39-1
Catalog Number:
AG01FA5F
Molecular Formula:
C9H13NO5S
Molecular Weight:
247.2682
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
96%
1 week
United States
$260
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Product Description
Catalog Number:
AG01FA5F
Chemical Name:
Ammonium 2-(ethoxycarbonyl)benzene-1-sulfonate
CAS Number:
164078-39-1
Molecular Formula:
C9H13NO5S
Molecular Weight:
247.2682
MDL Number:
MFCD01961503
IUPAC Name:
azanium;2-ethoxycarbonylbenzenesulfonate
InChI:
InChI=1S/C9H10O5S.H3N/c1-2-14-9(10)7-5-3-4-6-8(7)15(11,12)13;/h3-6H,2H2,1H3,(H,11,12,13);1H3
InChI Key:
PIEVLKQFOVFAFR-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccccc1S(=O)(=O)[O-].[NH4+]
Properties
Complexity:
303  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.051g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
247.265g/mol
Monoisotopic Mass:
247.051g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
92.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties