Home Other Building Blocks Methyl 2-iodo-4-(trifluoromethyl)benzoate

Methyl 2-iodo-4-(trifluoromethyl)benzoate

CAS No.:
1236303-09-5
Catalog Number:
AG000KVW
Molecular Formula:
C9H6F3IO2
Molecular Weight:
330.0424
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$75
- +
1g
98%
In Stock USA
United States
$94
- +
5g
98%
In Stock USA
United States
$282
- +
Product Description
Catalog Number:
AG000KVW
Chemical Name:
Methyl 2-iodo-4-(trifluoromethyl)benzoate
CAS Number:
1236303-09-5
Molecular Formula:
C9H6F3IO2
Molecular Weight:
330.0424
MDL Number:
MFCD18399512
IUPAC Name:
methyl 2-iodo-4-(trifluoromethyl)benzoate
InChI:
InChI=1S/C9H6F3IO2/c1-15-8(14)6-3-2-5(4-7(6)13)9(10,11)12/h2-4H,1H3
InChI Key:
POAMKOUDAYEPCD-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(cc1I)C(F)(F)F
Properties
Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.936g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
330.045g/mol
Monoisotopic Mass:
329.936g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Properties