Home Sulfos 4-(oxolan-2-ylmethanesulfonyl)aniline

4-(oxolan-2-ylmethanesulfonyl)aniline

CAS No.:
1250946-19-0
Catalog Number:
AG01AGXJ
Molecular Formula:
C11H15NO3S
Molecular Weight:
241.3067
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Product Description
Catalog Number:
AG01AGXJ
Chemical Name:
4-(oxolan-2-ylmethanesulfonyl)aniline
CAS Number:
1250946-19-0
Molecular Formula:
C11H15NO3S
Molecular Weight:
241.3067
MDL Number:
MFCD18330012
IUPAC Name:
4-(oxolan-2-ylmethylsulfonyl)aniline
InChI:
InChI=1S/C11H15NO3S/c12-9-3-5-11(6-4-9)16(13,14)8-10-2-1-7-15-10/h3-6,10H,1-2,7-8,12H2
InChI Key:
PVAXIWJHFXKEQQ-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)S(=O)(=O)CC1CCCO1
Properties
Complexity:
315  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.077g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
241.305g/mol
Monoisotopic Mass:
241.077g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties