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95333-74-7 | 2H-Imidazole-2-thione, 1-[(4-fluorophenyl)methyl]-1,3-dihydro-
CAS No: 95333-74-7 Catalog No: AG01FM2X MDL No:MFCD11201086
Product Description
Catalog Number:
AG01FM2X
Chemical Name:
2H-Imidazole-2-thione, 1-[(4-fluorophenyl)methyl]-1,3-dihydro-
CAS Number:
95333-74-7
Molecular Formula:
C10H9FN2S
Molecular Weight:
208.2553
MDL Number:
MFCD11201086
IUPAC Name:
3-[(4-fluorophenyl)methyl]-1H-imidazole-2-thione
InChI:
InChI=1S/C10H9FN2S/c11-9-3-1-8(2-4-9)7-13-6-5-12-10(13)14/h1-6H,7H2,(H,12,14)
InChI Key:
AWRNKBMEDXPMIN-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)Cn1ccnc1S
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.047g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
208.254g/mol
Monoisotopic Mass:
208.047g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
47.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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