Home Carboxys Ethyl 4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carboxylate

Ethyl 4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carboxylate

CAS No.:
1080026-94-3
Catalog Number:
AG007DOP
Molecular Formula:
C10H13NO2S
Molecular Weight:
211.2807
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Product Description
Catalog Number:
AG007DOP
Chemical Name:
Ethyl 4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carboxylate
CAS Number:
1080026-94-3
Molecular Formula:
C10H13NO2S
Molecular Weight:
211.2807
MDL Number:
MFCD10566074
IUPAC Name:
ethyl 4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carboxylate
InChI:
InChI=1S/C10H13NO2S/c1-2-13-10(12)9-5-7-6-11-4-3-8(7)14-9/h5,11H,2-4,6H2,1H3
InChI Key:
HLYOOHYZCZJODO-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc2c(s1)CCNC2
Properties
Complexity:
222  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.067g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
211.279g/mol
Monoisotopic Mass:
211.067g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties