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Home > Pyridines > 492431-12-6
492431-12-6 | 1-Boc-4-(Pyridazin-3-yl)piperazine
CAS No: 492431-12-6 Catalog No: AG00DKRS MDL No:MFCD19689624
Product Description
Catalog Number:
AG00DKRS
Chemical Name:
1-Boc-4-(Pyridazin-3-yl)piperazine
CAS Number:
492431-12-6
Molecular Formula:
C13H20N4O2
Molecular Weight:
264.3235
MDL Number:
MFCD19689624
IUPAC Name:
tert-butyl 4-pyridazin-3-ylpiperazine-1-carboxylate
InChI:
InChI=1S/C13H20N4O2/c1-13(2,3)19-12(18)17-9-7-16(8-10-17)11-5-4-6-14-15-11/h4-6H,7-10H2,1-3H3
InChI Key:
KNCRBGIXAOVMQM-UHFFFAOYSA-N
SMILES:
O=C(N1CCN(CC1)c1cccnn1)OC(C)(C)C
Properties
Complexity:
308
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.159g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.329g/mol
Monoisotopic Mass:
264.159g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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