Home Sulfos Methyl 4-(butane-1-sulfonamido)benzoate

Methyl 4-(butane-1-sulfonamido)benzoate

CAS No.:
892878-71-6
Catalog Number:
AG00IFMO
Molecular Formula:
C12H17NO4S
Molecular Weight:
271.3327
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$450
- +
10g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG00IFMO
Chemical Name:
Methyl 4-(butane-1-sulfonamido)benzoate
CAS Number:
892878-71-6
Molecular Formula:
C12H17NO4S
Molecular Weight:
271.3327
MDL Number:
MFCD05116247
IUPAC Name:
methyl 4-(butylsulfonylamino)benzoate
InChI:
InChI=1S/C12H17NO4S/c1-3-4-9-18(15,16)13-11-7-5-10(6-8-11)12(14)17-2/h5-8,13H,3-4,9H2,1-2H3
InChI Key:
JPOBDMZEQJKVKA-UHFFFAOYSA-N
SMILES:
CCCCS(=O)(=O)Nc1ccc(cc1)C(=O)OC
Properties
Complexity:
353  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.088g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
271.331g/mol
Monoisotopic Mass:
271.088g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
80.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties