Home Sulfos 4-bromo-3-methanesulfonylaniline

4-bromo-3-methanesulfonylaniline

CAS No.:
1375473-63-4
Catalog Number:
AG019TCD
Molecular Formula:
C7H8BrNO2S
Molecular Weight:
250.1129
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Product Description
Catalog Number:
AG019TCD
Chemical Name:
4-bromo-3-methanesulfonylaniline
CAS Number:
1375473-63-4
Molecular Formula:
C7H8BrNO2S
Molecular Weight:
250.1129
MDL Number:
MFCD21602552
IUPAC Name:
4-bromo-3-methylsulfonylaniline
InChI:
InChI=1S/C7H8BrNO2S/c1-12(10,11)7-4-5(9)2-3-6(7)8/h2-4H,9H2,1H3
InChI Key:
GAHLARZDAZEHBG-UHFFFAOYSA-N
SMILES:
Nc1ccc(c(c1)S(=O)(=O)C)Br
Properties
Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.946g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
250.11g/mol
Monoisotopic Mass:
248.946g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
68.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties