Home Other Building Blocks 4-difluoromethanesulfinylaniline

4-difluoromethanesulfinylaniline

CAS No.:
24906-88-5
Catalog Number:
AG019QUN
Molecular Formula:
C7H7F2NOS
Molecular Weight:
191.1984
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Product Description
Catalog Number:
AG019QUN
Chemical Name:
4-difluoromethanesulfinylaniline
CAS Number:
24906-88-5
Molecular Formula:
C7H7F2NOS
Molecular Weight:
191.1984
MDL Number:
MFCD00856961
IUPAC Name:
4-(difluoromethylsulfinyl)aniline
InChI:
InChI=1S/C7H7F2NOS/c8-7(9)12(11)6-3-1-5(10)2-4-6/h1-4,7H,10H2
InChI Key:
UZTPYPWZQDZXCR-UHFFFAOYSA-N
SMILES:
FC(S(=O)c1ccc(cc1)N)F
Properties
Complexity:
169  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.022g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
191.196g/mol
Monoisotopic Mass:
191.022g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
62.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties