Home Amines 52516-30-0
52516-30-0,MFCD00040756
Catalog No.:AA003I86
52516-30-0 | 3-(Trifluoromethyl)phenethylamine
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$19.00   $13.00
- +
5g
95%
in stock  
$62.00   $43.00
- +
10g
95%
in stock  
$115.00   $80.00
- +
25g
98%
in stock  
$222.00   $155.00
- +
100g
98%
in stock  
$627.00   $439.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003I86
Chemical Name:
3-(Trifluoromethyl)phenethylamine
CAS Number:
52516-30-0
Molecular Formula:
C9H10F3N
Molecular Weight:
189.1776
MDL Number:
MFCD00040756
IUPAC Name:
2-[3-(trifluoromethyl)phenyl]ethanamine
InChI:
InChI=1S/C9H10F3N/c10-9(11,12)8-3-1-2-7(6-8)4-5-13/h1-3,6H,4-5,13H2
InChI Key:
BPVYCXMGJPKOTQ-UHFFFAOYSA-N
SMILES:
NCCc1cccc(c1)C(F)(F)F
EC Number:
257-988-3
Properties
Computed Properties
 
Complexity:
155  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.077g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
189.181g/mol
Monoisotopic Mass:
189.077g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  

Synonyms
 
52516-30-0 
2-(3-(trifluoromethyl)phenyl)ethanamine 
MFCD00040756 
Benzeneethanamine, 3-(trifluoromethyl)- 
2-[3-(trifluoromethyl)phenyl]ethanamine 
CHEMBL448523 
2-(3-trifluoromethylphenyl)-ethylamine 
(2-[3-(Trifluoromethyl)phenyl]ethyl)amine 
2-[3-(trifluoromethyl)phenyl]ethan-1-amine 
{2-[3-(TRIFLUOROMETHYL)PHENYL]ETHYL}AMINE 
3-(Trifluoromethyl)phenethylamine, 98% 
2-(3-(trifluoromethyl)phenyl)ethylamine 
3-(trifluoromethyl)phenethylamine 
AC1L2WD3 
AC1Q4JT6 
SCHEMBL40017 
3-trifluoromethylphenethylamine 
m-trifluoromethyl-phenethylamin 
3-trifluoromethylphenethyl-amine 
RARECHEM AL BW 0212 
CTK4J6037 
DTXSID90200517 
BPVYCXMGJPKOTQ-UHFFFAOYSA-N 
2-(3-trifluoromethylphenyl)ethylamine 
3-(Trifluoromethoxy)phenethylamine 
3-trifluoromethyl-phen-ethyl-amine 
KS-000000QE 
ZINC2389992 
3-(Trifluoromethyl)benzeneethanamine 
BBL102913 
BDBM50262796 
CK1123 
SBB084517 
STL556722 
2-[3-(trifluoromethyl)phenyl]ethylamine 
2-(3-trifluoromethylphenyl)ethanamine 
AKOS000159379 
2-(3-trifluoromethylphenyl)ethyl amine 
AS00489 
Benzeneethanamine,3-(trifluoromethyl)- 
CM13558 
CS-W005053 
MCULE-2844602486 
2-(3-trifluoromethyl-phenyl)-ethylamine 
3-(2-AMINOETHYL)BENZOTRIFLUORIDE 
Phenethylamine, m-trifluoromethyl- 
2-(3-trifluoromethyl-phenyl) ethyl amine 
AJ-35639 
AK117504 
AS-19453 
BC226735 
SC-07703 
AB0034210 
DB-021779 
LS-103728 
4CH-022129 
m-Trifluoromethylphenethylamine 
FT-0610857 
ST24039280 
ST50405606 
X8324 
X-3181 
{2-[3-(TRIFLUOROMETHYL)PHENYL]ETHYLAMINE 
C9H10F3N 
C9-H10-F3-N 
AR-1D6796 
CID104223 
BRN 4398117 
ACN-050608 
T3086 
3-(Trifluoromethyl)phenethylamine, 98% - 1G 1g 
5346-47-4 
m-(Trifluoromethyl)phenethylamine 
EINECS 257-988-3 
Literature

Title: Simultaneous chiral separation of methylamphetamine and common precursors using gas chromatography/mass spectrometry.

Journal: Chirality 20110901

Title: Structure-activity correlations for beta-phenethylamines at human trace amine receptor 1.

Journal: Bioorganic & medicinal chemistry 20080801

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