Home Carboxys 2-Thiophenecarboxylicacid,3-hydroxy-4-nitro-,methylester(7CI,9CI)

2-Thiophenecarboxylicacid,3-hydroxy-4-nitro-,methylester(7CI,9CI)

CAS No.:
89380-76-7
Catalog Number:
AG00GU49
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00GU49
Chemical Name:
2-Thiophenecarboxylicacid,3-hydroxy-4-nitro-,methylester(7CI,9CI)
CAS Number:
89380-76-7
MDL Number:
MFCD09260846
IUPAC Name:
methyl 3-hydroxy-4-nitrothiophene-2-carboxylate
InChI:
InChI=1S/C6H5NO5S/c1-12-6(9)5-4(8)3(2-13-5)7(10)11/h2,8H,1H3
InChI Key:
SWWYFSVAMWJJTO-UHFFFAOYSA-N
Properties
Complexity:
228  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.989g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
203.168g/mol
Monoisotopic Mass:
202.989g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
121A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties