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Home > Imidazoles > 1198420-87-9
1198420-87-9 | 1-Ethoxycarbonyl-4-imidazol-2-ylpiperidine
CAS No: 1198420-87-9 Catalog No: AG01EQYP MDL No:
Product Description
Catalog Number:
AG01EQYP
Chemical Name:
1-Ethoxycarbonyl-4-imidazol-2-ylpiperidine
CAS Number:
1198420-87-9
Molecular Formula:
C11H17N3O2
Molecular Weight:
223.2716
IUPAC Name:
ethyl 4-(1H-imidazol-2-yl)piperidine-1-carboxylate
InChI:
InChI=1S/C11H17N3O2/c1-2-16-11(15)14-7-3-9(4-8-14)10-12-5-6-13-10/h5-6,9H,2-4,7-8H2,1H3,(H,12,13)
InChI Key:
KDKYTVUHWKJCGU-UHFFFAOYSA-N
SMILES:
CCOC(=O)N1CCC(CC1)c1ncc[nH]1
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.132g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
223.276g/mol
Monoisotopic Mass:
223.132g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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