Home Carboxys methyl 4-hydroxy-1-benzothiophene-2-carboxylate

methyl 4-hydroxy-1-benzothiophene-2-carboxylate

CAS No.:
310391-14-1
Catalog Number:
AG01B6TF
Molecular Formula:
C10H8O3S
Molecular Weight:
208.2337
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Product Description
Catalog Number:
AG01B6TF
Chemical Name:
methyl 4-hydroxy-1-benzothiophene-2-carboxylate
CAS Number:
310391-14-1
Molecular Formula:
C10H8O3S
Molecular Weight:
208.2337
MDL Number:
MFCD13180873
IUPAC Name:
methyl 4-hydroxy-1-benzothiophene-2-carboxylate
InChI:
InChI=1S/C10H8O3S/c1-13-10(12)9-5-6-7(11)3-2-4-8(6)14-9/h2-5,11H,1H3
InChI Key:
FXOKIHHTHSAQLP-UHFFFAOYSA-N
SMILES:
COC(=O)c1sc2c(c1)c(O)ccc2
Properties
Complexity:
231  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.019g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
208.231g/mol
Monoisotopic Mass:
208.019g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
74.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties