Home Fluorides 369-68-6
369-68-6,MFCD00190130
Catalog No.:AA003I8G
369-68-6 | 3-(Trifluoromethylthio)aniline
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$36.00   $25.00
- +
5g
98%
in stock  
$122.00   $85.00
- +
25g
98%
in stock  
$445.00   $312.00
- +
100g
98%
in stock  
$1,334.00   $934.00
  • Technical Information
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  • Technical Information
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Technical Information
Catalog Number:
AA003I8G
Chemical Name:
3-(Trifluoromethylthio)aniline
CAS Number:
369-68-6
Molecular Formula:
C7H6F3NS
Molecular Weight:
193.1894
MDL Number:
MFCD00190130
IUPAC Name:
3-(trifluoromethylsulfanyl)aniline
InChI:
InChI=1S/C7H6F3NS/c8-7(9,10)12-6-3-1-2-5(11)4-6/h1-4H,11H2
InChI Key:
DENPAKQJZNDKEL-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1)SC(F)(F)F
EC Number:
206-722-4
Properties
Computed Properties
 
Complexity:
148  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.017g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
193.187g/mol
Monoisotopic Mass:
193.017g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
51.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  

Synonyms
 
3-(TRIFLUOROMETHYLTHIO)ANILINE 
369-68-6 
3-(trifluoromethylthio)phenylamine 
Benzeneamine, 3-((trifluoromethyl)thio)- 
EINECS 206-722-4 
PubChem8443 
ACMC-1CJOM 
AC1MC4GG 
SCHEMBL656796 
3-(trifluoromethylthio) aniline 
DTXSID9073171 
CTK4H7486 
3-[(trifluoromethyl)sulfanyl]aniline 
DENPAKQJZNDKEL-UHFFFAOYSA-N 
3-Aminophenyltrifluoromethylsulphide 
ACT00173 
KS-00003SG0 
ZINC2556422 
ANW-47134 
BBL102674 
RW1203 
SBB091565 
STL556478 
3-Aminophenyl trifluoromethyl sulphide 
3-[(Trifluoromethyl)sulphanyl]aniline 
AKOS005254400 
AS04598 
CM11536 
LS10209 
MCULE-8854807729 
VZ26342 
Benzenamine,3-[(trifluoromethyl)thio]- 
AJ-39894 
AN-44591 
3-Aminophenyl trifluoromethyl sulfide 
BR-45012 
SC-78488 
TS-00269 
DB-006348 
ST2417430 
TR-015072 
FT-0613961 
ST50825346 
W5813 
S-4900 
3-((Trifluoromethyl)thio)aniline 
A823487 
I14-29578 
C7H6F3NS 
3- ANILINE 
3-[(trifluoromethyl)thio]aniline 
C7-H6-F3-N-S 
ZINC02556422 
CID2735939 
Benzenamine, 3-((trifluoromethyl)thio)- 
3-(Trifluoromethylthio)aniline, 96% 1g 
3-(trifluoromethylsulfanyl)aniline 
Benzeneamine, 3-[(trifluoromethyl)thio]- 
MFCD00190130 
Benzenamine, 3-[(trifluoromethyl)thio]- 
Literature
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