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1263283-48-2 | 1,2,4-Triazolo[4,3-a]pyridin-6-amine, 3-bromo-
CAS No: 1263283-48-2 Catalog No: AG000SMQ MDL No:MFCD17677031
Product Description
Catalog Number:
AG000SMQ
Chemical Name:
1,2,4-Triazolo[4,3-a]pyridin-6-amine, 3-bromo-
CAS Number:
1263283-48-2
Molecular Formula:
C6H5BrN4
Molecular Weight:
213.0347
MDL Number:
MFCD17677031
IUPAC Name:
3-bromo-[1,2,4]triazolo[4,3-a]pyridin-6-amine
InChI:
InChI=1S/C6H5BrN4/c7-6-10-9-5-2-1-4(8)3-11(5)6/h1-3H,8H2
InChI Key:
BCENHUIZTVBBCU-UHFFFAOYSA-N
SMILES:
Nc1ccc2n(c1)c(Br)nn2
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.97g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
213.038g/mol
Monoisotopic Mass:
211.97g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
56.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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