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Home > Pyridines > 1384430-58-3
1384430-58-3 | {3-methyl-5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyridin-6-yl}methanol
CAS No: 1384430-58-3 Catalog No: AG019ZJF MDL No:MFCD22369976
Product Description
Catalog Number:
AG019ZJF
Chemical Name:
{3-methyl-5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyridin-6-yl}methanol
CAS Number:
1384430-58-3
Molecular Formula:
C8H13N3O
Molecular Weight:
167.2083
MDL Number:
MFCD22369976
IUPAC Name:
(3-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-6-yl)methanol
InChI:
InChI=1S/C8H13N3O/c1-6-9-10-8-3-2-7(5-12)4-11(6)8/h7,12H,2-5H2,1H3
InChI Key:
UDYCPDPVMWJYTO-UHFFFAOYSA-N
SMILES:
OCC1CCc2n(C1)c(C)nn2
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.106g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
167.212g/mol
Monoisotopic Mass:
167.106g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
50.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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