Home Carboxys 5-tert-butyl 6-methyl (6S)-3H,4H,6H,7H-imidazo[4,5-c]pyridine-5,6-dicarboxylate

5-tert-butyl 6-methyl (6S)-3H,4H,6H,7H-imidazo[4,5-c]pyridine-5,6-dicarboxylate

CAS No.:
1820579-36-9
Catalog Number:
AG00I0E8
Molecular Formula:
C13H19N3O4
Molecular Weight:
281.3077
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$563
- +
5g
96%
In Stock USA
United States
$1500
- +
Product Description
Catalog Number:
AG00I0E8
Chemical Name:
5-tert-butyl 6-methyl (6S)-3H,4H,6H,7H-imidazo[4,5-c]pyridine-5,6-dicarboxylate
CAS Number:
1820579-36-9
Molecular Formula:
C13H19N3O4
Molecular Weight:
281.3077
MDL Number:
MFCD27578447
IUPAC Name:
5-O-tert-butyl 6-O-methyl 3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5,6-dicarboxylate
InChI:
InChI=1S/C13H19N3O4/c1-13(2,3)20-12(18)16-6-9-8(14-7-15-9)5-10(16)11(17)19-4/h7,10H,5-6H2,1-4H3,(H,14,15)
InChI Key:
LGMBOMJYCVXRBA-UHFFFAOYSA-N
SMILES:
COC(=O)[C@@H]1Cc2nc[nH]c2CN1C(=O)OC(C)(C)C
Properties
Complexity:
394  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.138g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
281.312g/mol
Monoisotopic Mass:
281.138g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
84.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties