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1227954-63-3 | tert-Butyl 4-(4-cyanopyridin-2-yl)homopiperazine-1-carboxylate
CAS No: 1227954-63-3 Catalog No: AG01FGJX MDL No:
Product Description
Catalog Number:
AG01FGJX
Chemical Name:
tert-Butyl 4-(4-cyanopyridin-2-yl)homopiperazine-1-carboxylate
CAS Number:
1227954-63-3
IUPAC Name:
tert-butyl 4-(4-cyanopyridin-2-yl)-1,4-diazepane-1-carboxylate
InChI:
InChI=1S/C16H22N4O2/c1-16(2,3)22-15(21)20-8-4-7-19(9-10-20)14-11-13(12-17)5-6-18-14/h5-6,11H,4,7-10H2,1-3H3
InChI Key:
YODWRULSTJVOKA-UHFFFAOYSA-N
Properties
Complexity:
437
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.174g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.378g/mol
Monoisotopic Mass:
302.174g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
69.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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