Home Carboxys Thieno[2,3-c]pyridine-2-carboxylic acid, 4,5,6,7-tetrahydro-, Methyl ester

Thieno[2,3-c]pyridine-2-carboxylic acid, 4,5,6,7-tetrahydro-, Methyl ester

CAS No.:
1259287-72-3
Catalog Number:
AG00AAAS
Molecular Formula:
C9H11NO2S
Molecular Weight:
197.2541
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Product Description
Catalog Number:
AG00AAAS
Chemical Name:
Thieno[2,3-c]pyridine-2-carboxylic acid, 4,5,6,7-tetrahydro-, Methyl ester
CAS Number:
1259287-72-3
Molecular Formula:
C9H11NO2S
Molecular Weight:
197.2541
MDL Number:
MFCD20688257
IUPAC Name:
methyl 4,5,6,7-tetrahydrothieno[2,3-c]pyridine-2-carboxylate
InChI:
InChI=1S/C9H11NO2S/c1-12-9(11)7-4-6-2-3-10-5-8(6)13-7/h4,10H,2-3,5H2,1H3
InChI Key:
ZBFJJGBWKCYVDY-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc2c(s1)CNCC2
Properties
Complexity:
210  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.051g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
197.252g/mol
Monoisotopic Mass:
197.051g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties