Home Other Building Blocks N-methyl-3-(methylsulfanyl)aniline

N-methyl-3-(methylsulfanyl)aniline

CAS No.:
52960-99-3
Catalog Number:
AG01A96B
Molecular Formula:
C8H11NS
Molecular Weight:
153.2446
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01A96B
Chemical Name:
N-methyl-3-(methylsulfanyl)aniline
CAS Number:
52960-99-3
Molecular Formula:
C8H11NS
Molecular Weight:
153.2446
MDL Number:
MFCD09702164
IUPAC Name:
N-methyl-3-methylsulfanylaniline
InChI:
InChI=1S/C8H11NS/c1-9-7-4-3-5-8(6-7)10-2/h3-6,9H,1-2H3
InChI Key:
HCBMXZNWPDLTKP-UHFFFAOYSA-N
SMILES:
CNc1cccc(c1)SC
Properties
Complexity:
95.3  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.061g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
153.243g/mol
Monoisotopic Mass:
153.061g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties