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23630-49-1

23630-49-1 | 1H-Thieno[3,2-e]benzimidazole (8CI,9CI)

CAS No: 23630-49-1 Catalog No: AG002NY7 MDL No:

Product Description

Catalog Number:
AG002NY7
Chemical Name:
1H-Thieno[3,2-e]benzimidazole (8CI,9CI)
CAS Number:
23630-49-1
Molecular Formula:
C9H6N2S
Molecular Weight:
174.2223
IUPAC Name:
3H-thieno[3,2-e]benzimidazole
InChI:
InChI=1S/C9H6N2S/c1-2-8-6(3-4-12-8)9-7(1)10-5-11-9/h1-5H,(H,10,11)
InChI Key:
GTACTEGISJCMII-UHFFFAOYSA-N
SMILES:
c1sc2c(c1)c1[nH]cnc1cc2

Properties

Complexity:
185  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.025g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
174.221g/mol
Monoisotopic Mass:
174.025g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
56.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  

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