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Home > Imidazoles > 858220-92-5
858220-92-5 | 1-methyl-2-(methylsulfanyl)-1H-imidazole hydrochloride
CAS No: 858220-92-5 Catalog No: AG01C5FH MDL No:MFCD27967273
Product Description
Catalog Number:
AG01C5FH
Chemical Name:
1-methyl-2-(methylsulfanyl)-1H-imidazole hydrochloride
CAS Number:
858220-92-5
Molecular Formula:
C5H9ClN2S
Molecular Weight:
164.6564
MDL Number:
MFCD27967273
IUPAC Name:
1-methyl-2-methylsulfanylimidazole;hydrochloride
InChI:
InChI=1S/C5H8N2S.ClH/c1-7-4-3-6-5(7)8-2;/h3-4H,1-2H3;1H
InChI Key:
PFKWQURQOAYLGG-UHFFFAOYSA-N
SMILES:
CSc1nccn1C.Cl
Properties
Complexity:
76.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.017g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
164.651g/mol
Monoisotopic Mass:
164.017g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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