Home Other Building Blocks Alpha-methyl-3-(trifluoromethyl)benzyl alcohol

Alpha-methyl-3-(trifluoromethyl)benzyl alcohol

CAS No.:
454-91-1
Catalog Number:
AG003DT8
Molecular Formula:
C9H9F3O
Molecular Weight:
190.1624
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$32
- +
5g
95%
In Stock USA
United States
$88
- +
10g
95%
In Stock USA
United States
$150
- +
25g
>97%
In Stock USA
United States
$193
- +
Product Description
Catalog Number:
AG003DT8
Chemical Name:
Alpha-methyl-3-(trifluoromethyl)benzyl alcohol
CAS Number:
454-91-1
Molecular Formula:
C9H9F3O
Molecular Weight:
190.1624
MDL Number:
MFCD00021868
IUPAC Name:
1-[3-(trifluoromethyl)phenyl]ethanol
InChI:
InChI=1S/C9H9F3O/c1-6(13)7-3-2-4-8(5-7)9(10,11)12/h2-6,13H,1H3
InChI Key:
YNVXCOKNHXMBQC-UHFFFAOYSA-N
SMILES:
CC(c1cccc(c1)C(F)(F)F)O
Properties
Complexity:
167  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.061g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
190.165g/mol
Monoisotopic Mass:
190.061g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties