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Home Other Building Blocks 2-(4-Trifluoromethyl-phenyl)-ethylamine

2-(4-Trifluoromethyl-phenyl)-ethylamine

CAS No.:
775-00-8
Catalog Number:
AG0035W1
Molecular Formula:
C9H10F3N
Molecular Weight:
189.1776
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$50
- +
10g
98%
In Stock USA
United States
$82
- +
25g
98%
In Stock USA
United States
$163
- +
100g
98%
In Stock USA
United States
$438
- +
Product Description
Catalog Number:
AG0035W1
Chemical Name:
2-(4-Trifluoromethyl-phenyl)-ethylamine
CAS Number:
775-00-8
Molecular Formula:
C9H10F3N
Molecular Weight:
189.1776
MDL Number:
MFCD01529875
IUPAC Name:
2-[4-(trifluoromethyl)phenyl]ethanamine
InChI:
InChI=1S/C9H10F3N/c10-9(11,12)8-3-1-7(2-4-8)5-6-13/h1-4H,5-6,13H2
InChI Key:
HMFOBPNVAAAACP-UHFFFAOYSA-N
SMILES:
NCCc1ccc(cc1)C(F)(F)F
Properties
Complexity:
147  
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  
Literature
Title Journal
Structure-activity correlations for beta-phenethylamines at human trace amine receptor 1. Bioorganic & medicinal chemistry 20080801
Properties