Home Carboxys 3-Thiophenecarboxylicacid,2-amino-4-(methoxymethyl)-,methylester(9CI)

3-Thiophenecarboxylicacid,2-amino-4-(methoxymethyl)-,methylester(9CI)

CAS No.:
349662-41-5
Catalog Number:
AG00D524
Molecular Formula:
C8H11NO3S
Molecular Weight:
201.2428
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Product Description
Catalog Number:
AG00D524
Chemical Name:
3-Thiophenecarboxylicacid,2-amino-4-(methoxymethyl)-,methylester(9CI)
CAS Number:
349662-41-5
Molecular Formula:
C8H11NO3S
Molecular Weight:
201.2428
MDL Number:
MFCD24626550
IUPAC Name:
methyl 2-amino-4-(methoxymethyl)thiophene-3-carboxylate
InChI:
InChI=1S/C8H11NO3S/c1-11-3-5-4-13-7(9)6(5)8(10)12-2/h4H,3,9H2,1-2H3
InChI Key:
IIRCGSQSPSUWAS-UHFFFAOYSA-N
SMILES:
COCc1csc(c1C(=O)OC)N
Properties
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.046g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
201.24g/mol
Monoisotopic Mass:
201.046g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
89.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties