Home Carboxys Methyl 4-cyanothiophene-2-carboxylate

Methyl 4-cyanothiophene-2-carboxylate

CAS No.:
67808-33-7
Catalog Number:
AG00IBRA
Molecular Formula:
C7H5NO2S
Molecular Weight:
167.1851
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
In Stock USA
United States
$219
- +
1g
97%
In Stock USA
United States
$469
- +
Product Description
Catalog Number:
AG00IBRA
Chemical Name:
Methyl 4-cyanothiophene-2-carboxylate
CAS Number:
67808-33-7
Molecular Formula:
C7H5NO2S
Molecular Weight:
167.1851
MDL Number:
MFCD05664843
IUPAC Name:
methyl 4-cyanothiophene-2-carboxylate
InChI:
InChI=1S/C7H5NO2S/c1-10-7(9)6-2-5(3-8)4-11-6/h2,4H,1H3
InChI Key:
TYOWYTNOORXRSB-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(cs1)C#N
Properties
Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.004g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
167.182g/mol
Monoisotopic Mass:
167.004g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
78.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties