sales@angenesci.com
Login | Register
logo
Structures Search
Home Carboxys 1-Piperazinecarboxylic acid, 4-(3-nitro-4-pyridinyl)-, 1,1-dimethylethylester

1-Piperazinecarboxylic acid, 4-(3-nitro-4-pyridinyl)-, 1,1-dimethylethylester

CAS No.:
608142-93-4
Catalog Number:
AG01DTMG
Molecular Formula:
C14H20N4O4
Molecular Weight:
308.3330
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$121
- +
250mg
95%
In Stock USA
United States
$219
- +
1g
95%
In Stock USA
United States
$437
- +
Product Description
Catalog Number:
AG01DTMG
Chemical Name:
1-Piperazinecarboxylic acid, 4-(3-nitro-4-pyridinyl)-, 1,1-dimethylethylester
CAS Number:
608142-93-4
Molecular Formula:
C14H20N4O4
Molecular Weight:
308.3330
MDL Number:
MFCD18207662
IUPAC Name:
tert-butyl 4-(3-nitropyridin-4-yl)piperazine-1-carboxylate
InChI:
InChI=1S/C14H20N4O4/c1-14(2,3)22-13(19)17-8-6-16(7-9-17)11-4-5-15-10-12(11)18(20)21/h4-5,10H,6-9H2,1-3H3
InChI Key:
BZCZLYVPOXHWMT-UHFFFAOYSA-N
SMILES:
O=C(N1CCN(CC1)c1ccncc1[N+](=O)[O-])OC(C)(C)C
Properties
Complexity:
410  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.148g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
308.338g/mol
Monoisotopic Mass:
308.148g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
91.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties