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Home > Imidazoles > 827017-62-9
827017-62-9 | 2(3H)-Furanone, 3,3-diethyl-5-[(2-ethyl-1H-imidazol-1-yl)methyl]dihydro-
CAS No: 827017-62-9 Catalog No: AG0051PA MDL No:
Product Description
Catalog Number:
AG0051PA
Chemical Name:
2(3H)-Furanone, 3,3-diethyl-5-[(2-ethyl-1H-imidazol-1-yl)methyl]dihydro-
CAS Number:
827017-62-9
Molecular Formula:
C14H22N2O2
Molecular Weight:
250.3367
IUPAC Name:
3,3-diethyl-5-[(2-ethylimidazol-1-yl)methyl]oxolan-2-one
InChI:
InChI=1S/C14H22N2O2/c1-4-12-15-7-8-16(12)10-11-9-14(5-2,6-3)13(17)18-11/h7-8,11H,4-6,9-10H2,1-3H3
InChI Key:
BFEKOVMTCKVUHD-UHFFFAOYSA-N
SMILES:
CCc1nccn1CC1OC(=O)C(C1)(CC)CC
Properties
Complexity:
302
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.168g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.342g/mol
Monoisotopic Mass:
250.168g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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