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920536-51-2

920536-51-2 | 2-Thiophenecarboxaldehyde, 5-[(6-methyl-1H-benzimidazol-2-yl)thio]-

CAS No: 920536-51-2 Catalog No: AG006DHU MDL No:

Product Description

Catalog Number:
AG006DHU
Chemical Name:
2-Thiophenecarboxaldehyde, 5-[(6-methyl-1H-benzimidazol-2-yl)thio]-
CAS Number:
920536-51-2
Molecular Formula:
C13H10N2OS2
Molecular Weight:
274.3613
IUPAC Name:
5-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]thiophene-2-carbaldehyde
InChI:
InChI=1S/C13H10N2OS2/c1-8-2-4-10-11(6-8)15-13(14-10)18-12-5-3-9(7-16)17-12/h2-7H,1H3,(H,14,15)
InChI Key:
DTZHOZAGHGKBPA-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(s1)Sc1nc2c([nH]1)cc(cc2)C

Properties

Complexity:
315  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.023g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
274.356g/mol
Monoisotopic Mass:
274.023g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
99.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  

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