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Home Carboxys 4-(6-Chloropyridazin-3-yl)piperazine-1-carboxylic acid tert-butyl ester

4-(6-Chloropyridazin-3-yl)piperazine-1-carboxylic acid tert-butyl ester

CAS No.:
492431-11-5
Catalog Number:
AG00DE1S
Molecular Formula:
C13H19ClN4O2
Molecular Weight:
298.7686
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$37
- +
5g
98%
In Stock USA
United States
$113
- +
10g
98%
In Stock USA
United States
$200
- +
25g
98%
In Stock USA
United States
$400
- +
Product Description
Catalog Number:
AG00DE1S
Chemical Name:
4-(6-Chloropyridazin-3-yl)piperazine-1-carboxylic acid tert-butyl ester
CAS Number:
492431-11-5
Molecular Formula:
C13H19ClN4O2
Molecular Weight:
298.7686
MDL Number:
MFCD05864738
IUPAC Name:
tert-butyl 4-(6-chloropyridazin-3-yl)piperazine-1-carboxylate
InChI:
InChI=1S/C13H19ClN4O2/c1-13(2,3)20-12(19)18-8-6-17(7-9-18)11-5-4-10(14)15-16-11/h4-5H,6-9H2,1-3H3
InChI Key:
MIXODQAAOQHDTG-UHFFFAOYSA-N
SMILES:
O=C(N1CCN(CC1)c1ccc(nn1)Cl)OC(C)(C)C
Properties
Complexity:
340  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.12g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
298.771g/mol
Monoisotopic Mass:
298.12g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties