Home Other Building Blocks 2-Methyl-4-(trifluoromethyl)phenol

2-Methyl-4-(trifluoromethyl)phenol

CAS No.:
77227-90-8
Catalog Number:
AG003ANG
Molecular Formula:
C8H7F3O
Molecular Weight:
176.1358
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$688
- +
5g
98%
In Stock USA
United States
$1875
- +
Product Description
Catalog Number:
AG003ANG
Chemical Name:
2-Methyl-4-(trifluoromethyl)phenol
CAS Number:
77227-90-8
Molecular Formula:
C8H7F3O
Molecular Weight:
176.1358
MDL Number:
MFCD16997488
IUPAC Name:
2-methyl-4-(trifluoromethyl)phenol
InChI:
InChI=1S/C8H7F3O/c1-5-4-6(8(9,10)11)2-3-7(5)12/h2-4,12H,1H3
InChI Key:
NBZPDMNDTOEKMG-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1C)C(F)(F)F
Properties
Complexity:
155  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.045g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
176.138g/mol
Monoisotopic Mass:
176.045g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties