Home Carbonyls Methyl 6-[(tert-butoxycarbonyl)amino]nicotinate

Methyl 6-[(tert-butoxycarbonyl)amino]nicotinate

CAS No.:
144186-11-8
Catalog Number:
AG001J2L
Molecular Formula:
C12H16N2O4
Molecular Weight:
252.2664
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$450
- +
10g
98%
In Stock USA
United States
$725
- +
Product Description
Catalog Number:
AG001J2L
Chemical Name:
Methyl 6-[(tert-butoxycarbonyl)amino]nicotinate
CAS Number:
144186-11-8
Molecular Formula:
C12H16N2O4
Molecular Weight:
252.2664
MDL Number:
MFCD05663797
IUPAC Name:
methyl 6-[(2-methylpropan-2-yl)oxycarbonylamino]pyridine-3-carboxylate
InChI:
InChI=1S/C12H16N2O4/c1-12(2,3)18-11(16)14-9-6-5-8(7-13-9)10(15)17-4/h5-7H,1-4H3,(H,13,14,16)
InChI Key:
KHMRKCRGUHPQLA-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(nc1)NC(=O)OC(C)(C)C
Properties
Complexity:
312  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.111g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
252.27g/mol
Monoisotopic Mass:
252.111g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
77.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties