1H-Imidazole-5-methanol, 2-(methylthio)-1-(phenylmethyl)-


Chemical Name: 1H-Imidazole-5-methanol, 2-(methylthio)-1-(phenylmethyl)-
CAS Number: 338414-90-7
Product Number: AG00C0YN(AGN-PC-09TXCQ)
Synonyms:
MDL No:
Molecular Formula: C12H14N2OS
Molecular Weight: 234.3174

Identification/Properties


Computed Properties
Molecular Weight:
234.317g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
234.083g/mol
Monoisotopic Mass:
234.083g/mol
Topological Polar Surface Area:
63.4A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
209
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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