CAS: 5464-11-9
Name: 2-methylsulfanyl-4,5-dihydro-1H-imidazole;hydroiodide
SMILES:
CSC1=NCCN1.IMolecular Processing
Molecular formula
C4H9IN2S
Molecular weight
244.1
Exact mass
243.9531
XLogP
0.93
TPSA
24.39
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
8
Rings
1
Aromatic rings
0
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
2
Fraction Csp3
0.75
Molar refractivity
49.23
Supplementary Information
InChIKey: PZZRSEUDGCFXIH-UHFFFAOYSA-N
Synonyme
5464-11-9RefChem:10579301H-Imidazole, 4,5-dihydro-2-(methylthio)-, hydriodide (1:1)2-Methylthio-2-imidazoline hydriodide2-(methylthio)-4,5-dihydro-1H-imidazole hydroiodideMFCD000051812-Methylthio-2-imidazoline, Hydroiodide2-Methylsulfanyl-4,5-dihydro-1H-imidazole hydrogen iodide2-(methylsulfanyl)-4,5-dihydro-1H-imidazole hydroiodide2-(Methylthio)-4,5-dihydroimidazole Hydroiodide2-methylsulfanyl-4,5-dihydro-1H-imidazole;hydroiodidehydron;2-methylsulfanyl-4,5-dihydro-1H-imidazole;iodideAKOS0033839742-methylsulfanyl-4,5-dihydro-1H-imidazol-3-ium;iodideF2147-03102-(Methylthio)imidazolinium iodide2-Methylmercapto-4,5-dihydroimidazole Hydroiodide2-Imidazoline, monohydriodideSCHEMBL315802DTXSID109699122-methylthio-2-imidazoline, iodide2-methylthioimidazoline, hydroiodideNSC26869GEO-01949NSC-26869SBB0558712-methylmercaptoimidazoline hydroiodide2-Methylthio-2-imidazolin HydroiodideAKOS005067919CS-W010263
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