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Home > Imidazoles > 141524-76-7
141524-76-7 | 1H-Imidazole-5-methanol, 1-methyl-4-(phenylthio)-
CAS No: 141524-76-7 Catalog No: AG001GK4 MDL No:
Product Description
Catalog Number:
AG001GK4
Chemical Name:
1H-Imidazole-5-methanol, 1-methyl-4-(phenylthio)-
CAS Number:
141524-76-7
Molecular Formula:
C11H12N2OS
Molecular Weight:
220.2908
IUPAC Name:
(3-methyl-5-phenylsulfanylimidazol-4-yl)methanol
InChI:
InChI=1S/C11H12N2OS/c1-13-8-12-11(10(13)7-14)15-9-5-3-2-4-6-9/h2-6,8,14H,7H2,1H3
InChI Key:
JYLZGYFJGRHPPV-UHFFFAOYSA-N
SMILES:
OCc1c(ncn1C)Sc1ccccc1
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.067g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
220.29g/mol
Monoisotopic Mass:
220.067g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
63.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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