Home Carboxys tert-Butyl 4-(cyano(phenyl)methyl)piperazine-1-carboxylate

tert-Butyl 4-(cyano(phenyl)methyl)piperazine-1-carboxylate

CAS No.:
444891-21-8
Catalog Number:
AG00DLAQ
Molecular Formula:
C17H23N3O2
Molecular Weight:
301.3834
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$133
- +
250mg
95%
In Stock USA
United States
$221
- +
1g
95%
In Stock USA
United States
$441
- +
Product Description
Catalog Number:
AG00DLAQ
Chemical Name:
tert-Butyl 4-(cyano(phenyl)methyl)piperazine-1-carboxylate
CAS Number:
444891-21-8
Molecular Formula:
C17H23N3O2
Molecular Weight:
301.3834
MDL Number:
MFCD09910427
IUPAC Name:
tert-butyl 4-[cyano(phenyl)methyl]piperazine-1-carboxylate
InChI:
InChI=1S/C17H23N3O2/c1-17(2,3)22-16(21)20-11-9-19(10-12-20)15(13-18)14-7-5-4-6-8-14/h4-8,15H,9-12H2,1-3H3
InChI Key:
MKDYPPSXUMRRJU-UHFFFAOYSA-N
SMILES:
N#CC(c1ccccc1)N1CCN(CC1)C(=O)OC(C)(C)C
Properties
Complexity:
421  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.179g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
301.39g/mol
Monoisotopic Mass:
301.179g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
56.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties