Home Other Building Blocks 2-(Trifluoromethyl)benzamide

2-(Trifluoromethyl)benzamide

CAS No.:
360-64-5
Catalog Number:
AG003F5H
Molecular Formula:
C8H6F3NO
Molecular Weight:
189.1345
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$19
- +
25g
98%
In Stock USA
United States
$57
- +
100g
98%
In Stock USA
United States
$188
- +
Product Description
Catalog Number:
AG003F5H
Chemical Name:
2-(Trifluoromethyl)benzamide
CAS Number:
360-64-5
Molecular Formula:
C8H6F3NO
Molecular Weight:
189.1345
MDL Number:
MFCD00014798
IUPAC Name:
2-(trifluoromethyl)benzamide
InChI:
InChI=1S/C8H6F3NO/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H2,12,13)
InChI Key:
QBAYIBZITZBSFO-UHFFFAOYSA-N
SMILES:
NC(=O)c1ccccc1C(F)(F)F
EC Number:
206-637-2
UNII:
5U8Y7E6AIO
Properties
Complexity:
202  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.04g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
189.137g/mol
Monoisotopic Mass:
189.04g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Literature
Title Journal
Self-assembly driven by an aromatic primary amide motif. Organic & biomolecular chemistry 20120728
Properties