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Home > Pyridines > 1422136-49-9
1422136-49-9 | 7-((allyloxy)methyl)-1-(cyclopropylmethyl)-4,5,6,7-tetrahydro-1H-[1,2,3]triazolo[4,5-c]pyridine
CAS No: 1422136-49-9 Catalog No: AG01DHKW MDL No:
Product Description
Catalog Number:
AG01DHKW
Chemical Name:
7-((allyloxy)methyl)-1-(cyclopropylmethyl)-4,5,6,7-tetrahydro-1H-[1,2,3]triazolo[4,5-c]pyridine
CAS Number:
1422136-49-9
Molecular Formula:
C13H20N4O
Molecular Weight:
248.3241
IUPAC Name:
1-(cyclopropylmethyl)-7-(prop-2-enoxymethyl)-4,5,6,7-tetrahydrotriazolo[4,5-c]pyridine
InChI:
InChI=1S/C13H20N4O/c1-2-5-18-9-11-6-14-7-12-13(11)17(16-15-12)8-10-3-4-10/h2,10-11,14H,1,3-9H2
InChI Key:
GCDAJKSTSMTNAY-UHFFFAOYSA-N
SMILES:
C=CCOCC1CNCc2c1n(nn2)CC1CC1
Properties
Complexity:
295
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.164g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
248.33g/mol
Monoisotopic Mass:
248.164g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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