Home Sulfos Sodium 3-(n-ethyl-3-methylanilino)propanesulfonate

Sodium 3-(n-ethyl-3-methylanilino)propanesulfonate

CAS No.:
40567-80-4
Catalog Number:
AG00I7YI
Molecular Formula:
C12H19NNaO3S
Molecular Weight:
280.3389
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
500mg
98%
1 week
United States
$168
- +
1g
98%
1 week
United States
$247
- +
5g
98%
1 week
United States
$623
- +
Product Description
Catalog Number:
AG00I7YI
Chemical Name:
Sodium 3-(n-ethyl-3-methylanilino)propanesulfonate
CAS Number:
40567-80-4
Molecular Formula:
C12H19NNaO3S
Molecular Weight:
280.3389
MDL Number:
MFCD00043050
IUPAC Name:
sodium;3-(N-ethyl-3-methylanilino)propane-1-sulfonate
InChI:
InChI=1S/C12H19NO3S.Na/c1-3-13(8-5-9-17(14,15)16)12-7-4-6-11(2)10-12;/h4,6-7,10H,3,5,8-9H2,1-2H3,(H,14,15,16);/q;+1/p-1
InChI Key:
NJZLCEFCAHNYIR-UHFFFAOYSA-M
SMILES:
CCN(c1cccc(c1)C)CCCS(=O)(=O)O.[Na]
Properties
Complexity:
316  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.091g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.33g/mol
Monoisotopic Mass:
279.091g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
68.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties