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Home > Pyridines > 1422062-52-9
1422062-52-9 | 7-(ethoxymethyl)-1-methyl-4,5,6,7-tetrahydro-1H-[1,2,3]triazolo[4,5-c]pyridine
CAS No: 1422062-52-9 Catalog No: AG01DIPC MDL No:
Product Description
Catalog Number:
AG01DIPC
Chemical Name:
7-(ethoxymethyl)-1-methyl-4,5,6,7-tetrahydro-1H-[1,2,3]triazolo[4,5-c]pyridine
CAS Number:
1422062-52-9
Molecular Formula:
C9H16N4O
Molecular Weight:
196.2495
IUPAC Name:
7-(ethoxymethyl)-1-methyl-4,5,6,7-tetrahydrotriazolo[4,5-c]pyridine
InChI:
InChI=1S/C9H16N4O/c1-3-14-6-7-4-10-5-8-9(7)13(2)12-11-8/h7,10H,3-6H2,1-2H3
InChI Key:
RNCCWXMJFVOJEL-UHFFFAOYSA-N
SMILES:
CCOCC1CNCc2c1n(C)nn2
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.132g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
196.254g/mol
Monoisotopic Mass:
196.132g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8
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