Home Carboxys Methyl benzothiophene-3-carboxylate

Methyl benzothiophene-3-carboxylate

CAS No.:
22913-25-3
Catalog Number:
AG002LHH
Molecular Formula:
C10H8O2S
Molecular Weight:
192.2343
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$188
- +
5g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG002LHH
Chemical Name:
Methyl benzothiophene-3-carboxylate
CAS Number:
22913-25-3
Molecular Formula:
C10H8O2S
Molecular Weight:
192.2343
MDL Number:
MFCD06203855
IUPAC Name:
methyl 1-benzothiophene-3-carboxylate
InChI:
InChI=1S/C10H8O2S/c1-12-10(11)8-6-13-9-5-3-2-4-7(8)9/h2-6H,1H3
InChI Key:
FSJAXBXCHWMNAB-UHFFFAOYSA-N
SMILES:
COC(=O)c1csc2c1cccc2
Properties
Complexity:
205  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.025g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.232g/mol
Monoisotopic Mass:
192.025g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
54.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties