Home Carboxys 3-M-Tolyl-piperazine-1-carboxylic acid tert-butyl ester

3-M-Tolyl-piperazine-1-carboxylic acid tert-butyl ester

CAS No.:
886766-73-0
Catalog Number:
AG00IFBZ
Molecular Formula:
C16H24N2O2
Molecular Weight:
276.3740
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$316
- +
1g
95%
1 week
United States
$734
- +
5g
95%
1 week
United States
$2125
- +
Product Description
Catalog Number:
AG00IFBZ
Chemical Name:
3-M-Tolyl-piperazine-1-carboxylic acid tert-butyl ester
CAS Number:
886766-73-0
Molecular Formula:
C16H24N2O2
Molecular Weight:
276.3740
MDL Number:
MFCD08685950
IUPAC Name:
tert-butyl 3-(3-methylphenyl)piperazine-1-carboxylate
InChI:
InChI=1S/C16H24N2O2/c1-12-6-5-7-13(10-12)14-11-18(9-8-17-14)15(19)20-16(2,3)4/h5-7,10,14,17H,8-9,11H2,1-4H3
InChI Key:
IKBHBWSKAGCUHE-UHFFFAOYSA-N
SMILES:
Cc1cccc(c1)C1NCCN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
338  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.184g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
276.38g/mol
Monoisotopic Mass:
276.184g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties