Home Halogens 3-Amino-4-(methylthio)benzotrifluoride

3-Amino-4-(methylthio)benzotrifluoride

CAS No.:
207974-07-0
Catalog Number:
AG002JD5
Molecular Formula:
C8H8F3NS
Molecular Weight:
207.2160
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
>98.0%(GC)(T)
1 week
United States
$182
- +
Product Description
Catalog Number:
AG002JD5
Chemical Name:
3-Amino-4-(methylthio)benzotrifluoride
CAS Number:
207974-07-0
Molecular Formula:
C8H8F3NS
Molecular Weight:
207.2160
MDL Number:
MFCD00052715
IUPAC Name:
2-methylsulfanyl-5-(trifluoromethyl)aniline
InChI:
InChI=1S/C8H8F3NS/c1-13-7-3-2-5(4-6(7)12)8(9,10)11/h2-4H,12H2,1H3
InChI Key:
OQFOLJGOVFYDHZ-UHFFFAOYSA-N
SMILES:
CSc1ccc(cc1N)C(F)(F)F
Properties
Complexity:
171  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.033g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
207.214g/mol
Monoisotopic Mass:
207.033g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
51.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties