Home Sulfos Methyl 4-(N-isopropylmethanesulfonamido)benzoate

Methyl 4-(N-isopropylmethanesulfonamido)benzoate

CAS No.:
1820686-46-1
Catalog Number:
AG00I0V1
Molecular Formula:
C12H17NO4S
Molecular Weight:
271.3327
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$75
- +
5g
97%
In Stock USA
United States
$225
- +
Product Description
Catalog Number:
AG00I0V1
Chemical Name:
Methyl 4-(N-isopropylmethanesulfonamido)benzoate
CAS Number:
1820686-46-1
Molecular Formula:
C12H17NO4S
Molecular Weight:
271.3327
MDL Number:
MFCD28166392
IUPAC Name:
methyl 4-[methylsulfonyl(propan-2-yl)amino]benzoate
InChI:
InChI=1S/C12H17NO4S/c1-9(2)13(18(4,15)16)11-7-5-10(6-8-11)12(14)17-3/h5-9H,1-4H3
InChI Key:
XVZINPUOUPOQAV-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(cc1)N(S(=O)(=O)C)C(C)C
Properties
Complexity:
377  
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:
0
Isotope Atom Count:
0
Molecular Weight:
271.331g/mol
Monoisotopic Mass:
271.088g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties