Home Carboxys 2-(Thiophen-2-yl)-1H-benzo[d]imidazole-5-carboxylic acid

2-(Thiophen-2-yl)-1H-benzo[d]imidazole-5-carboxylic acid

CAS No.:
174422-11-8
Catalog Number:
AG001ZN6
Molecular Formula:
C12H8N2O2S
Molecular Weight:
244.2691
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Product Description
Catalog Number:
AG001ZN6
Chemical Name:
2-(Thiophen-2-yl)-1H-benzo[d]imidazole-5-carboxylic acid
CAS Number:
174422-11-8
Molecular Formula:
C12H8N2O2S
Molecular Weight:
244.2691
MDL Number:
MFCD02182736
IUPAC Name:
2-thiophen-2-yl-3H-benzimidazole-5-carboxylic acid
InChI:
InChI=1S/C12H8N2O2S/c15-12(16)7-3-4-8-9(6-7)14-11(13-8)10-2-1-5-17-10/h1-6H,(H,13,14)(H,15,16)
InChI Key:
HNBAEALJFFNPFK-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc2c(c1)[nH]c(n2)c1cccs1
Properties
Complexity:
313  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.031g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
244.268g/mol
Monoisotopic Mass:
244.031g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
94.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties