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Home Sulfos N-Ethyl-n-benzylaniline-3'-sulfonic acid

N-Ethyl-n-benzylaniline-3'-sulfonic acid

CAS No.:
101-11-1
Catalog Number:
AG0003F0
Molecular Formula:
C15H17NO3S
Molecular Weight:
291.3654
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
95%
In Stock USA
United States
$32
- +
25g
95%
In Stock USA
United States
$113
- +
100g
95%
In Stock USA
United States
$338
- +
Product Description
Catalog Number:
AG0003F0
Chemical Name:
N-Ethyl-n-benzylaniline-3'-sulfonic acid
CAS Number:
101-11-1
Molecular Formula:
C15H17NO3S
Molecular Weight:
291.3654
MDL Number:
MFCD00035761
IUPAC Name:
3-[(N-ethylanilino)methyl]benzenesulfonic acid
InChI:
InChI=1S/C15H17NO3S/c1-2-16(14-8-4-3-5-9-14)12-13-7-6-10-15(11-13)20(17,18)19/h3-11H,2,12H2,1H3,(H,17,18,19)
InChI Key:
BQGRVFPPZJPWPB-UHFFFAOYSA-N
SMILES:
CCN(c1ccccc1)Cc1cccc(c1)S(=O)(=O)O
EC Number:
202-916-8
UNII:
9CA7X98HXU
Properties
Complexity:
384  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.093g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
291.365g/mol
Monoisotopic Mass:
291.093g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties