Home Carboxys Methyl 5-(trifluoromethyl)-1-benzothiophene-2-carboxylate

Methyl 5-(trifluoromethyl)-1-benzothiophene-2-carboxylate

CAS No.:
146137-92-0
Catalog Number:
AG001DPT
Molecular Formula:
C11H7F3O2S
Molecular Weight:
260.2323
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%(GC)
In Stock USA
United States
$201
- +
5g
98%(GC)
In Stock USA
United States
$572
- +
Product Description
Catalog Number:
AG001DPT
Chemical Name:
Methyl 5-(trifluoromethyl)-1-benzothiophene-2-carboxylate
CAS Number:
146137-92-0
Molecular Formula:
C11H7F3O2S
Molecular Weight:
260.2323
MDL Number:
MFCD03012932
IUPAC Name:
methyl 5-(trifluoromethyl)-1-benzothiophene-2-carboxylate
InChI:
InChI=1S/C11H7F3O2S/c1-16-10(15)9-5-6-4-7(11(12,13)14)2-3-8(6)17-9/h2-5H,1H3
InChI Key:
JWHOGTDVUZFYNO-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc2c(s1)ccc(c2)C(F)(F)F
Properties
Complexity:
306  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.012g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.23g/mol
Monoisotopic Mass:
260.012g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
54.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Properties