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2-methanesulfinylaniline

CAS No.:
41085-32-9
Catalog Number:
AG019W9S
Molecular Formula:
C7H9NOS
Molecular Weight:
155.2175
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Product Description
Catalog Number:
AG019W9S
Chemical Name:
2-methanesulfinylaniline
CAS Number:
41085-32-9
Molecular Formula:
C7H9NOS
Molecular Weight:
155.2175
MDL Number:
MFCD14631764
IUPAC Name:
2-methylsulfinylaniline
InChI:
InChI=1S/C7H9NOS/c1-10(9)7-5-3-2-4-6(7)8/h2-5H,8H2,1H3
InChI Key:
OGUIFELBZNMXGH-UHFFFAOYSA-N
SMILES:
CS(=O)c1ccccc1N
Properties
Complexity:
138  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.04g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
155.215g/mol
Monoisotopic Mass:
155.04g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
62.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties