Home Other Building Blocks 4-(Trifluoromethoxy)phenylacetylene

4-(Trifluoromethoxy)phenylacetylene

CAS No.:
160542-02-9
Catalog Number:
AG001S0S
Molecular Formula:
C9H5F3O
Molecular Weight:
186.1306
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$84
- +
5g
98%
In Stock USA
United States
$333
- +
10g
98%
In Stock USA
United States
$570
- +
25g
98%
In Stock USA
United States
$1140
- +
Product Description
Catalog Number:
AG001S0S
Chemical Name:
4-(Trifluoromethoxy)phenylacetylene
CAS Number:
160542-02-9
Molecular Formula:
C9H5F3O
Molecular Weight:
186.1306
MDL Number:
MFCD03094333
IUPAC Name:
1-ethynyl-4-(trifluoromethoxy)benzene
InChI:
InChI=1S/C9H5F3O/c1-2-7-3-5-8(6-4-7)13-9(10,11)12/h1,3-6H
InChI Key:
RWWGGRCLMVYXPM-UHFFFAOYSA-N
SMILES:
C#Cc1ccc(cc1)OC(F)(F)F
Properties
Complexity:
205  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.029g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.133g/mol
Monoisotopic Mass:
186.029g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties