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Home > Imidazoles > 32023-93-1
32023-93-1 | 4H-Imidazol-4-one, 3,5-dihydro-2,3,5-trimethyl-
CAS No: 32023-93-1 Catalog No: AG007HNW MDL No:
Product Description
Catalog Number:
AG007HNW
Chemical Name:
4H-Imidazol-4-one, 3,5-dihydro-2,3,5-trimethyl-
CAS Number:
32023-93-1
Molecular Formula:
C6H10N2O
Molecular Weight:
126.1564
IUPAC Name:
1,2,4-trimethyl-4H-imidazol-5-one
InChI:
InChI=1S/C6H10N2O/c1-4-6(9)8(3)5(2)7-4/h4H,1-3H3
InChI Key:
WFXDHDDBCTZAED-UHFFFAOYSA-N
SMILES:
O=C1C(C)N=C(N1C)C
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.079g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
126.159g/mol
Monoisotopic Mass:
126.079g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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