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Home Sulfos 4-(Methylsulfonyl)-3-morpholinobenzoic acid

4-(Methylsulfonyl)-3-morpholinobenzoic acid

CAS No.:
1197193-19-3
Catalog Number:
AG000PIX
Molecular Formula:
C12H15NO5S
Molecular Weight:
285.3162
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$125
- +
1g
>95%
In Stock USA
United States
$248
- +
Product Description
Catalog Number:
AG000PIX
Chemical Name:
4-(Methylsulfonyl)-3-morpholinobenzoic acid
CAS Number:
1197193-19-3
Molecular Formula:
C12H15NO5S
Molecular Weight:
285.3162
MDL Number:
MFCD13191608
IUPAC Name:
4-methylsulfonyl-3-morpholin-4-ylbenzoic acid
InChI:
InChI=1S/C12H15NO5S/c1-19(16,17)11-3-2-9(12(14)15)8-10(11)13-4-6-18-7-5-13/h2-3,8H,4-7H2,1H3,(H,14,15)
InChI Key:
KGBOPGFDGBEMSK-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(c(c1)N1CCOCC1)S(=O)(=O)C
Properties
Complexity:
424  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.067g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
285.314g/mol
Monoisotopic Mass:
285.067g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
92.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties