Home Carboxys tert-Butyl 4-(2-isopropyl-2H-tetrazol-5-yl)piperazine-1-carboxylate

tert-Butyl 4-(2-isopropyl-2H-tetrazol-5-yl)piperazine-1-carboxylate

CAS No.:
1245645-41-3
Catalog Number:
AG009VYU
Molecular Formula:
C13H24N6O2
Molecular Weight:
296.3687
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$952
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Product Description
Catalog Number:
AG009VYU
Chemical Name:
tert-Butyl 4-(2-isopropyl-2H-tetrazol-5-yl)piperazine-1-carboxylate
CAS Number:
1245645-41-3
Molecular Formula:
C13H24N6O2
Molecular Weight:
296.3687
MDL Number:
MFCD12911422
IUPAC Name:
tert-butyl 4-(2-propan-2-yltetrazol-5-yl)piperazine-1-carboxylate
InChI:
InChI=1S/C13H24N6O2/c1-10(2)19-15-11(14-16-19)17-6-8-18(9-7-17)12(20)21-13(3,4)5/h10H,6-9H2,1-5H3
InChI Key:
QEMDJHFHYJEGMI-UHFFFAOYSA-N
SMILES:
O=C(N1CCN(CC1)c1nnn(n1)C(C)C)OC(C)(C)C
Properties
Complexity:
362  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.196g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
296.375g/mol
Monoisotopic Mass:
296.196g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
76.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties