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Home > Pyridines > 1909316-75-1
1909316-75-1 | 1-(2,4,4-trimethylpentan-2-yl)-1H,4H,5H,6H,7H-[1,2,3]triazolo[4,5-c]pyridine hydrochloride
CAS No: 1909316-75-1 Catalog No: AG01C24I MDL No:MFCD29047577
Product Description
Catalog Number:
AG01C24I
Chemical Name:
1-(2,4,4-trimethylpentan-2-yl)-1H,4H,5H,6H,7H-[1,2,3]triazolo[4,5-c]pyridine hydrochloride
CAS Number:
1909316-75-1
Molecular Formula:
C13H25ClN4
Molecular Weight:
272.8174
MDL Number:
MFCD29047577
IUPAC Name:
1-(2,4,4-trimethylpentan-2-yl)-4,5,6,7-tetrahydrotriazolo[4,5-c]pyridine;hydrochloride
InChI:
InChI=1S/C13H24N4.ClH/c1-12(2,3)9-13(4,5)17-11-6-7-14-8-10(11)15-16-17;/h14H,6-9H2,1-5H3;1H
InChI Key:
QFVKAABQZXKWRJ-UHFFFAOYSA-N
SMILES:
CC(CC(n1nnc2c1CCNC2)(C)C)(C)C.Cl
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.177g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
272.821g/mol
Monoisotopic Mass:
272.177g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
42.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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