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Home > Imidazoles > 1015846-63-5
1015846-63-5 | 1-(2-ethyl-1H-imidazol-1-yl)acetone
CAS No: 1015846-63-5 Catalog No: AG00J374 MDL No:MFCD09971287
Product Description
Catalog Number:
AG00J374
Chemical Name:
1-(2-ethyl-1H-imidazol-1-yl)acetone
CAS Number:
1015846-63-5
Molecular Formula:
C8H12N2O
Molecular Weight:
152.1937
MDL Number:
MFCD09971287
IUPAC Name:
1-(2-ethylimidazol-1-yl)propan-2-one
InChI:
InChI=1S/C8H12N2O/c1-3-8-9-4-5-10(8)6-7(2)11/h4-5H,3,6H2,1-2H3
InChI Key:
MDLJJPUNYDXLOY-UHFFFAOYSA-N
SMILES:
CCc1nccn1CC(=O)C
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.095g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.197g/mol
Monoisotopic Mass:
152.095g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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