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83490-14-6 | 2-Thiophenecarboxaldehyde, 5-(1-methyl-1H-benzimidazol-2-yl)-
CAS No: 83490-14-6 Catalog No: AG0059CM MDL No:
Product Description
Catalog Number:
AG0059CM
Chemical Name:
2-Thiophenecarboxaldehyde, 5-(1-methyl-1H-benzimidazol-2-yl)-
CAS Number:
83490-14-6
Molecular Formula:
C13H10N2OS
Molecular Weight:
242.2963
IUPAC Name:
5-(1-methylbenzimidazol-2-yl)thiophene-2-carbaldehyde
InChI:
InChI=1S/C13H10N2OS/c1-15-11-5-3-2-4-10(11)14-13(15)12-7-6-9(8-16)17-12/h2-8H,1H3
InChI Key:
KWTIMXKKCXQFCD-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(s1)c1nc2c(n1C)cccc2
Properties
Complexity:
299
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.051g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.296g/mol
Monoisotopic Mass:
242.051g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
63.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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