sales@angenesci.com
Login | Register
logo
Structures Search
Home Other Building Blocks 4-(Trifluoromethyl)benzylamine

4-(Trifluoromethyl)benzylamine

CAS No.:
3300-51-4
Catalog Number:
AG0033U9
Molecular Formula:
C8H8F3N
Molecular Weight:
175.1510
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$25
- +
25g
98%
In Stock USA
United States
$63
- +
Product Description
Catalog Number:
AG0033U9
Chemical Name:
4-(Trifluoromethyl)benzylamine
CAS Number:
3300-51-4
Molecular Formula:
C8H8F3N
Molecular Weight:
175.1510
MDL Number:
MFCD00010220
IUPAC Name:
[4-(trifluoromethyl)phenyl]methanamine
InChI:
InChI=1S/C8H8F3N/c9-8(10,11)7-3-1-6(5-12)2-4-7/h1-4H,5,12H2
InChI Key:
PRDBLLIPPDOICK-UHFFFAOYSA-N
SMILES:
NCc1ccc(cc1)C(F)(F)F
EC Number:
221-971-9
Properties
Complexity:
136  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.061g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
175.154g/mol
Monoisotopic Mass:
175.061g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Assembly of organic monolayers on polydicyclopentadiene. Langmuir : the ACS journal of surfaces and colloids 20080916
One-step photochemical attachment of NHS-terminated monolayers onto silicon surfaces and subsequent functionalization. Langmuir : the ACS journal of surfaces and colloids 20080805
Structural Development Studies of Subtype-Selective Ligands for Peroxisome Proliferator-Activated Receptors (PPARs) Based on the 3,4-Disubstituted Phenylpropanoic Acid Scaffold as a Versatile Template. PPAR research 20080101
New efficient substrates for semicarbazide-sensitive amine oxidase/VAP-1 enzyme: analysis by SARs and computational docking. Journal of medicinal chemistry 20061019
Benzylamines: synthesis and evaluation of antimycobacterial properties. Journal of medicinal chemistry 19840901
Properties