Home Carboxys tert-butyl 4-butanoylpiperazine-1-carboxylate

tert-butyl 4-butanoylpiperazine-1-carboxylate

CAS No.:
913952-85-9
Catalog Number:
AG01AN48
Molecular Formula:
C13H24N2O3
Molecular Weight:
256.3413
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Product Description
Catalog Number:
AG01AN48
Chemical Name:
tert-butyl 4-butanoylpiperazine-1-carboxylate
CAS Number:
913952-85-9
Molecular Formula:
C13H24N2O3
Molecular Weight:
256.3413
MDL Number:
MFCD16892450
IUPAC Name:
tert-butyl 4-butanoylpiperazine-1-carboxylate
InChI:
InChI=1S/C13H24N2O3/c1-5-6-11(16)14-7-9-15(10-8-14)12(17)18-13(2,3)4/h5-10H2,1-4H3
InChI Key:
VTEZWIZGYSMACB-UHFFFAOYSA-N
SMILES:
CCCC(=O)N1CCN(CC1)C(=O)OC(C)(C)C
Properties
Complexity:
302  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.179g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.346g/mol
Monoisotopic Mass:
256.179g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties