Home Carboxys 5-(tert-Butoxycarbonyl)-1-ethyl-4,5,6,7-tetrahydro-1H-[1,2,3]triazolo[4,5-c]pyridine-7-carboxylic acid

5-(tert-Butoxycarbonyl)-1-ethyl-4,5,6,7-tetrahydro-1H-[1,2,3]triazolo[4,5-c]pyridine-7-carboxylic acid

CAS No.:
1391733-65-5
Catalog Number:
AG00HVG5
Molecular Formula:
C13H20N4O4
Molecular Weight:
296.3223
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$378
- +
250mg
95%
In Stock USA
United States
$714
- +
1g
95%
In Stock USA
United States
$1470
- +
5g
95%
In Stock USA
United States
$4410
- +
Product Description
Catalog Number:
AG00HVG5
Chemical Name:
5-(tert-Butoxycarbonyl)-1-ethyl-4,5,6,7-tetrahydro-1H-[1,2,3]triazolo[4,5-c]pyridine-7-carboxylic acid
CAS Number:
1391733-65-5
Molecular Formula:
C13H20N4O4
Molecular Weight:
296.3223
MDL Number:
MFCD23378414
IUPAC Name:
1-ethyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-6,7-dihydro-4H-triazolo[4,5-c]pyridine-7-carboxylic acid
InChI:
InChI=1S/C13H20N4O4/c1-5-17-10-8(11(18)19)6-16(7-9(10)14-15-17)12(20)21-13(2,3)4/h8H,5-7H2,1-4H3,(H,18,19)
InChI Key:
ICRDMQXZYFMJNL-UHFFFAOYSA-N
SMILES:
CCn1nnc2c1C(CN(C2)C(=O)OC(C)(C)C)C(=O)O
Properties
Complexity:
423  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.148g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
296.327g/mol
Monoisotopic Mass:
296.148g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
97.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties