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Home > Pyridines > 1422138-44-0
1422138-44-0 | 1-ethyl-4-(methoxymethyl)-4,5,6,7-tetrahydro-1H-[1,2,3]triazolo[4,5-c]pyridine
CAS No: 1422138-44-0 Catalog No: AG01DIP8 MDL No:
Product Description
Catalog Number:
AG01DIP8
Chemical Name:
1-ethyl-4-(methoxymethyl)-4,5,6,7-tetrahydro-1H-[1,2,3]triazolo[4,5-c]pyridine
CAS Number:
1422138-44-0
Molecular Formula:
C9H16N4O
Molecular Weight:
196.2495
IUPAC Name:
1-ethyl-4-(methoxymethyl)-4,5,6,7-tetrahydrotriazolo[4,5-c]pyridine
InChI:
InChI=1S/C9H16N4O/c1-3-13-8-4-5-10-7(6-14-2)9(8)11-12-13/h7,10H,3-6H2,1-2H3
InChI Key:
LQNVGIDXSHEPDK-UHFFFAOYSA-N
SMILES:
COCC1NCCc2c1nnn2CC
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:
-0.6
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