Home Carboxys methyl 2-amino-4H,5H,6H,7H-thieno[2,3-c]pyridine-3-carboxylate hydrochloride

methyl 2-amino-4H,5H,6H,7H-thieno[2,3-c]pyridine-3-carboxylate hydrochloride

CAS No.:
1049767-69-2
Catalog Number:
AG00HAJW
Molecular Formula:
C9H13ClN2O2S
Molecular Weight:
248.7297
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Product Description
Catalog Number:
AG00HAJW
Chemical Name:
methyl 2-amino-4H,5H,6H,7H-thieno[2,3-c]pyridine-3-carboxylate hydrochloride
CAS Number:
1049767-69-2
Molecular Formula:
C9H13ClN2O2S
Molecular Weight:
248.7297
MDL Number:
MFCD07843132
IUPAC Name:
methyl 2-amino-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate;hydrochloride
InChI:
InChI=1S/C9H12N2O2S.ClH/c1-13-9(12)7-5-2-3-11-4-6(5)14-8(7)10;/h11H,2-4,10H2,1H3;1H
InChI Key:
WXYWKYRPBIYBDK-UHFFFAOYSA-N
SMILES:
COC(=O)c1c(N)sc2c1CCNC2.Cl
Properties
Complexity:
237  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.039g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
248.725g/mol
Monoisotopic Mass:
248.039g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
92.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties