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45753-18-2

45753-18-2 | 4,5-DIHYDRO-2-(2-THIENYL)-1H-IMIDAZOLE

CAS No: 45753-18-2 Catalog No: AG00DBXZ MDL No:MFCD09743857

Product Description

Catalog Number:
AG00DBXZ
Chemical Name:
4,5-DIHYDRO-2-(2-THIENYL)-1H-IMIDAZOLE
CAS Number:
45753-18-2
Molecular Formula:
C7H8N2S
Molecular Weight:
152.2168
MDL Number:
MFCD09743857
IUPAC Name:
2-thiophen-2-yl-4,5-dihydro-1H-imidazole
InChI:
InChI=1S/C7H8N2S/c1-2-6(10-5-1)7-8-3-4-9-7/h1-2,5H,3-4H2,(H,8,9)
InChI Key:
WKJSKRCSMISIOY-UHFFFAOYSA-N
SMILES:
C1CN=C(N1)c1cccs1

Properties

Complexity:
156  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.041g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
152.215g/mol
Monoisotopic Mass:
152.041g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  

Literature

Title Journal
Erratum: 2-(2-Thien-yl)-4,5-dihydro-1H-imidazole. Corrigendum. Acta crystallographica. Section E, Structure reports online 20090601
2-(2-Thien-yl)-4,5-dihydro-1H-imidazole. Acta crystallographica. Section E, Structure reports online 20090201

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