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334917-74-7

334917-74-7 | 4-[(thiophen-2-yl)methyl]-1H-imidazole hydrochloride

CAS No: 334917-74-7 Catalog No: AG01BCGG MDL No:MFCD28714806

Product Description

Catalog Number:
AG01BCGG
Chemical Name:
4-[(thiophen-2-yl)methyl]-1H-imidazole hydrochloride
CAS Number:
334917-74-7
Molecular Formula:
C8H9ClN2S
Molecular Weight:
200.6885
MDL Number:
MFCD28714806
IUPAC Name:
5-(thiophen-2-ylmethyl)-1H-imidazole;hydrochloride
InChI:
InChI=1S/C8H8N2S.ClH/c1-2-8(11-3-1)4-7-5-9-6-10-7;/h1-3,5-6H,4H2,(H,9,10);1H
InChI Key:
KYFBBRSBINZMEG-UHFFFAOYSA-N
SMILES:
c1csc(c1)Cc1c[nH]cn1.Cl

Properties

Complexity:
129  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.017g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
200.684g/mol
Monoisotopic Mass:
200.017g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
56.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Literature

Title Journal
Alpha(2) adrenoceptor agonists as potential analgesic agents. 3. Imidazolylmethylthiophenes. Journal of medicinal chemistry 20010315

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