Home Other Building Blocks Methyl 4-hydroxy-3-(trifluoromethyl)benzoate

Methyl 4-hydroxy-3-(trifluoromethyl)benzoate

CAS No.:
115933-50-1
Catalog Number:
AG000H50
Molecular Formula:
C9H7F3O3
Molecular Weight:
220.1453
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$34
- +
5g
97%
In Stock USA
United States
$144
- +
25g
97%
In Stock USA
United States
$475
- +
100g
97%
In Stock USA
United States
$1500
- +
Product Description
Catalog Number:
AG000H50
Chemical Name:
Methyl 4-hydroxy-3-(trifluoromethyl)benzoate
CAS Number:
115933-50-1
Molecular Formula:
C9H7F3O3
Molecular Weight:
220.1453
MDL Number:
MFCD06204091
IUPAC Name:
methyl 4-hydroxy-3-(trifluoromethyl)benzoate
InChI:
InChI=1S/C9H7F3O3/c1-15-8(14)5-2-3-7(13)6(4-5)9(10,11)12/h2-4,13H,1H3
InChI Key:
WIXKYCQCCJXQPN-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(c(c1)C(F)(F)F)O
Properties
Complexity:
239  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.035g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
220.147g/mol
Monoisotopic Mass:
220.035g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties