Home Carboxys 5-tert-Butyl 7-methyl 1-ethyl-6,7-dihydro-1h-[1,2,3]triazolo[4,5-c]pyridine-5,7(4h)-dicarboxylate

5-tert-Butyl 7-methyl 1-ethyl-6,7-dihydro-1h-[1,2,3]triazolo[4,5-c]pyridine-5,7(4h)-dicarboxylate

CAS No.:
1391732-98-1
Catalog Number:
AG00HVFH
Molecular Formula:
C14H22N4O4
Molecular Weight:
310.3489
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$357
- +
250mg
95%
In Stock USA
United States
$693
- +
1g
95%
In Stock USA
United States
$1386
- +
Product Description
Catalog Number:
AG00HVFH
Chemical Name:
5-tert-Butyl 7-methyl 1-ethyl-6,7-dihydro-1h-[1,2,3]triazolo[4,5-c]pyridine-5,7(4h)-dicarboxylate
CAS Number:
1391732-98-1
Molecular Formula:
C14H22N4O4
Molecular Weight:
310.3489
MDL Number:
MFCD23378422
IUPAC Name:
5-O-tert-butyl 7-O-methyl 1-ethyl-6,7-dihydro-4H-triazolo[4,5-c]pyridine-5,7-dicarboxylate
InChI:
InChI=1S/C14H22N4O4/c1-6-18-11-9(12(19)21-5)7-17(8-10(11)15-16-18)13(20)22-14(2,3)4/h9H,6-8H2,1-5H3
InChI Key:
ZXYISKBNCFRHMO-UHFFFAOYSA-N
SMILES:
COC(=O)C1CN(Cc2c1n(CC)nn2)C(=O)OC(C)(C)C
Properties
Complexity:
437  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.164g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
310.354g/mol
Monoisotopic Mass:
310.164g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
86.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties