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14610-11-8

14610-11-8 | 1H-Benzimidazole, 2-(ethylthio)-

CAS No: 14610-11-8 Catalog No: AG001DPJ MDL No:MFCD00223154

Product Description

Catalog Number:
AG001DPJ
Chemical Name:
1H-Benzimidazole, 2-(ethylthio)-
CAS Number:
14610-11-8
Molecular Formula:
C9H10N2S
Molecular Weight:
178.2541
MDL Number:
MFCD00223154
IUPAC Name:
2-ethylsulfanyl-1H-benzimidazole
InChI:
InChI=1S/C9H10N2S/c1-2-12-9-10-7-5-3-4-6-8(7)11-9/h3-6H,2H2,1H3,(H,10,11)
InChI Key:
UGCOPUIBNABIEP-UHFFFAOYSA-N
SMILES:
CCSc1nc2c([nH]1)cccc2

Properties

Complexity:
152  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.056g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
178.253g/mol
Monoisotopic Mass:
178.056g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  

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