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Home > Imidazoles > 623547-64-8
623547-64-8 | 2H-Imidazol-2-one,1,3-dihydro-4-(1-methylethyl)-(9CI)
CAS No: 623547-64-8 Catalog No: AG00EX5O MDL No:MFCD18814689
Product Description
Catalog Number:
AG00EX5O
Chemical Name:
2H-Imidazol-2-one,1,3-dihydro-4-(1-methylethyl)-(9CI)
CAS Number:
623547-64-8
Molecular Formula:
C6H10N2O
Molecular Weight:
126.1564
MDL Number:
MFCD18814689
IUPAC Name:
4-propan-2-yl-1,3-dihydroimidazol-2-one
InChI:
InChI=1S/C6H10N2O/c1-4(2)5-3-7-6(9)8-5/h3-4H,1-2H3,(H2,7,8,9)
InChI Key:
DSJJTODXPFTCAO-UHFFFAOYSA-N
SMILES:
CC(c1c[nH]c(=O)[nH]1)C
Properties
Complexity:
160
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:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
126.159g/mol
Monoisotopic Mass:
126.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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