Home Halogens tert-Butyl (2-chloro-5-(trifluoromethyl)pyridin-4-yl)carbamate

tert-Butyl (2-chloro-5-(trifluoromethyl)pyridin-4-yl)carbamate

CAS No.:
1956363-89-5
Catalog Number:
AG01DJBB
Molecular Formula:
C11H12ClF3N2O2
Molecular Weight:
296.6734
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$367
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Product Description
Catalog Number:
AG01DJBB
Chemical Name:
tert-Butyl (2-chloro-5-(trifluoromethyl)pyridin-4-yl)carbamate
CAS Number:
1956363-89-5
Molecular Formula:
C11H12ClF3N2O2
Molecular Weight:
296.6734
MDL Number:
MFCD29059332
IUPAC Name:
tert-butyl N-[2-chloro-5-(trifluoromethyl)pyridin-4-yl]carbamate
InChI:
InChI=1S/C11H12ClF3N2O2/c1-10(2,3)19-9(18)17-7-4-8(12)16-5-6(7)11(13,14)15/h4-5H,1-3H3,(H,16,17,18)
InChI Key:
VOJQOLWGMPXHIW-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)Nc1cc(Cl)ncc1C(F)(F)F
Properties
Complexity:
331  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.054g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
296.674g/mol
Monoisotopic Mass:
296.054g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties