Home Sulfos 3-[(2-Methanesulfonyl-5-nitrophenyl)amino]propan-1-ol

3-[(2-Methanesulfonyl-5-nitrophenyl)amino]propan-1-ol

CAS No.:
1437795-14-6
Catalog Number:
AG00AQKA
Molecular Formula:
C10H14N2O5S
Molecular Weight:
274.2936
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$219
- +
5g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG00AQKA
Chemical Name:
3-[(2-Methanesulfonyl-5-nitrophenyl)amino]propan-1-ol
CAS Number:
1437795-14-6
Molecular Formula:
C10H14N2O5S
Molecular Weight:
274.2936
MDL Number:
MFCD24448762
IUPAC Name:
3-(2-methylsulfonyl-5-nitroanilino)propan-1-ol
InChI:
InChI=1S/C10H14N2O5S/c1-18(16,17)10-4-3-8(12(14)15)7-9(10)11-5-2-6-13/h3-4,7,11,13H,2,5-6H2,1H3
InChI Key:
XNIVBUCQZYGBAL-UHFFFAOYSA-N
SMILES:
OCCCNc1cc(ccc1S(=O)(=O)C)[N+](=O)[O-]
Properties
Complexity:
373  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.062g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
274.291g/mol
Monoisotopic Mass:
274.062g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
121A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties