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Home > Imidazoles > 99482-60-7
99482-60-7 | 2H-Imidazol-2-one, 1,3-dihydro-4-methyl-5-pentyl-
CAS No: 99482-60-7 Catalog No: AG006NQ9 MDL No:
Product Description
Catalog Number:
AG006NQ9
Chemical Name:
2H-Imidazol-2-one, 1,3-dihydro-4-methyl-5-pentyl-
CAS Number:
99482-60-7
Molecular Formula:
C9H16N2O
Molecular Weight:
168.2361
IUPAC Name:
4-methyl-5-pentyl-1,3-dihydroimidazol-2-one
InChI:
InChI=1S/C9H16N2O/c1-3-4-5-6-8-7(2)10-9(12)11-8/h3-6H2,1-2H3,(H2,10,11,12)
InChI Key:
BQSBGTBNUSFIFV-UHFFFAOYSA-N
SMILES:
Cc1c(CCCCC)[nH]c(=O)[nH]1
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.126g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
168.24g/mol
Monoisotopic Mass:
168.126g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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