Home Halogens Methyl 2-chloro-3-(trifluoromethyl)benzoate

Methyl 2-chloro-3-(trifluoromethyl)benzoate

CAS No.:
378231-19-7
Catalog Number:
AG00CLSL
Molecular Formula:
C9H6ClF3O2
Molecular Weight:
238.5909
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$100
- +
5g
98%
In Stock USA
United States
$300
- +
10g
98%
In Stock USA
United States
$525
- +
25g
98%
In Stock USA
United States
$1050
- +
Product Description
Catalog Number:
AG00CLSL
Chemical Name:
Methyl 2-chloro-3-(trifluoromethyl)benzoate
CAS Number:
378231-19-7
Molecular Formula:
C9H6ClF3O2
Molecular Weight:
238.5909
MDL Number:
MFCD06203770
IUPAC Name:
methyl 2-chloro-3-(trifluoromethyl)benzoate
InChI:
InChI=1S/C9H6ClF3O2/c1-15-8(14)5-3-2-4-6(7(5)10)9(11,12)13/h2-4H,1H3
InChI Key:
LEECXUQPLLXGGK-UHFFFAOYSA-N
SMILES:
COC(=O)c1cccc(c1Cl)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:
238.001g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.59g/mol
Monoisotopic Mass:
238.001g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties