Home Halogens 3-chloro-2-methanesulfinylaniline

3-chloro-2-methanesulfinylaniline

CAS No.:
1375471-66-1
Catalog Number:
AG019TJY
Molecular Formula:
C7H8ClNOS
Molecular Weight:
189.6625
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Product Description
Catalog Number:
AG019TJY
Chemical Name:
3-chloro-2-methanesulfinylaniline
CAS Number:
1375471-66-1
Molecular Formula:
C7H8ClNOS
Molecular Weight:
189.6625
MDL Number:
MFCD21602658
IUPAC Name:
3-chloro-2-methylsulfinylaniline
InChI:
InChI=1S/C7H8ClNOS/c1-11(10)7-5(8)3-2-4-6(7)9/h2-4H,9H2,1H3
InChI Key:
GTVNMFWKFIBXJM-UHFFFAOYSA-N
SMILES:
CS(=O)c1c(N)cccc1Cl
Properties
Complexity:
165  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.002g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
189.657g/mol
Monoisotopic Mass:
189.002g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
62.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties