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Home Halogens tert-Butyl 4-(2-chloro-4-nitrophenyl)piperazine-1-carboxylate

tert-Butyl 4-(2-chloro-4-nitrophenyl)piperazine-1-carboxylate

CAS No.:
193902-80-6
Catalog Number:
AG00I31D
Molecular Formula:
C15H20ClN3O4
Molecular Weight:
341.7900
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$88
- +
5g
98%
In Stock USA
United States
$313
- +
10g
98%
In Stock USA
United States
$563
- +
25g
98%
In Stock USA
United States
$1113
- +
Product Description
Catalog Number:
AG00I31D
Chemical Name:
tert-Butyl 4-(2-chloro-4-nitrophenyl)piperazine-1-carboxylate
CAS Number:
193902-80-6
Molecular Formula:
C15H20ClN3O4
Molecular Weight:
341.7900
MDL Number:
MFCD06408838
IUPAC Name:
tert-butyl 4-(2-chloro-4-nitrophenyl)piperazine-1-carboxylate
InChI:
InChI=1S/C15H20ClN3O4/c1-15(2,3)23-14(20)18-8-6-17(7-9-18)13-5-4-11(19(21)22)10-12(13)16/h4-5,10H,6-9H2,1-3H3
InChI Key:
HTMRIXVUKSIEPV-UHFFFAOYSA-N
SMILES:
O=C(N1CCN(CC1)c1ccc(cc1Cl)[N+](=O)[O-])OC(C)(C)C
Properties
Complexity:
441  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
341.114g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
341.792g/mol
Monoisotopic Mass:
341.114g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
78.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties