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1267378-18-6 | 1-Piperazinecarboxylic acid, 4-(2-oxocyclohexyl)-, 1,1-dimethylethyl ester
CAS No: 1267378-18-6 Catalog No: AG000T5F MDL No:MFCD19343247
Product Description
Catalog Number:
AG000T5F
Chemical Name:
1-Piperazinecarboxylic acid, 4-(2-oxocyclohexyl)-, 1,1-dimethylethyl ester
CAS Number:
1267378-18-6
Molecular Formula:
C15H26N2O3
Molecular Weight:
282.3785
MDL Number:
MFCD19343247
IUPAC Name:
tert-butyl 4-(2-oxocyclohexyl)piperazine-1-carboxylate
InChI:
InChI=1S/C15H26N2O3/c1-15(2,3)20-14(19)17-10-8-16(9-11-17)12-6-4-5-7-13(12)18/h12H,4-11H2,1-3H3
InChI Key:
WPTDGLONFNMPDM-UHFFFAOYSA-N
SMILES:
O=C(N1CCN(CC1)C1CCCCC1=O)OC(C)(C)C
Properties
Complexity:
368
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.194g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
282.384g/mol
Monoisotopic Mass:
282.194g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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