Home Sulfos 4-(3-methoxypropanesulfonyl)aniline

4-(3-methoxypropanesulfonyl)aniline

CAS No.:
1247164-58-4
Catalog Number:
AG01AIHP
Molecular Formula:
C10H15NO3S
Molecular Weight:
229.2960
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Product Description
Catalog Number:
AG01AIHP
Chemical Name:
4-(3-methoxypropanesulfonyl)aniline
CAS Number:
1247164-58-4
Molecular Formula:
C10H15NO3S
Molecular Weight:
229.2960
MDL Number:
MFCD14643845
IUPAC Name:
4-(3-methoxypropylsulfonyl)aniline
InChI:
InChI=1S/C10H15NO3S/c1-14-7-2-8-15(12,13)10-5-3-9(11)4-6-10/h3-6H,2,7-8,11H2,1H3
InChI Key:
BLPNTHKVBBORLN-UHFFFAOYSA-N
SMILES:
COCCCS(=O)(=O)c1ccc(cc1)N
Properties
Complexity:
263  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.077g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
229.294g/mol
Monoisotopic Mass:
229.077g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties