Home Carboxys tert-Butyl 4-(3-cyanophenyl)piperazine-1-carboxylate

tert-Butyl 4-(3-cyanophenyl)piperazine-1-carboxylate

CAS No.:
807624-20-0
Catalog Number:
AG00G9CA
Molecular Formula:
C16H21N3O2
Molecular Weight:
287.3568
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$150
- +
5g
95%
In Stock USA
United States
$450
- +
10g
95%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG00G9CA
Chemical Name:
tert-Butyl 4-(3-cyanophenyl)piperazine-1-carboxylate
CAS Number:
807624-20-0
Molecular Formula:
C16H21N3O2
Molecular Weight:
287.3568
MDL Number:
MFCD11042238
IUPAC Name:
tert-butyl 4-(3-cyanophenyl)piperazine-1-carboxylate
InChI:
InChI=1S/C16H21N3O2/c1-16(2,3)21-15(20)19-9-7-18(8-10-19)14-6-4-5-13(11-14)12-17/h4-6,11H,7-10H2,1-3H3
InChI Key:
CAHGMTOVXFIRAF-UHFFFAOYSA-N
SMILES:
N#Cc1cccc(c1)N1CCN(CC1)C(=O)OC(C)(C)C
Properties
Complexity:
413  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.163g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
287.363g/mol
Monoisotopic Mass:
287.163g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
56.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties