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Home > Imidazoles > 6794-69-0
6794-69-0 | 4-PHENYL-1,3-DIHYDRO-IMIDAZOL-2-ONE
CAS No: 6794-69-0 Catalog No: AG006218 MDL No:MFCD00518909
Product Description
Catalog Number:
AG006218
Chemical Name:
4-PHENYL-1,3-DIHYDRO-IMIDAZOL-2-ONE
CAS Number:
6794-69-0
Molecular Formula:
C9H8N2O
Molecular Weight:
160.1726
MDL Number:
MFCD00518909
IUPAC Name:
4-phenyl-1,3-dihydroimidazol-2-one
InChI:
InChI=1S/C9H8N2O/c12-9-10-6-8(11-9)7-4-2-1-3-5-7/h1-6H,(H2,10,11,12)
InChI Key:
JUCLXFPLJNDBJO-UHFFFAOYSA-N
SMILES:
O=c1[nH]cc([nH]1)c1ccccc1
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.064g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
160.176g/mol
Monoisotopic Mass:
160.064g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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