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1375302-31-0 | [1,2,4]Triazolo[1,5-a]pyridine, 6-(chloromethyl)-2-methyl-
CAS No: 1375302-31-0 Catalog No: AG0013IJ MDL No:
Product Description
Catalog Number:
AG0013IJ
Chemical Name:
[1,2,4]Triazolo[1,5-a]pyridine, 6-(chloromethyl)-2-methyl-
CAS Number:
1375302-31-0
Molecular Formula:
C8H8ClN3
Molecular Weight:
181.6222
IUPAC Name:
6-(chloromethyl)-2-methyl-[1,2,4]triazolo[1,5-a]pyridine
InChI:
InChI=1S/C8H8ClN3/c1-6-10-8-3-2-7(4-9)5-12(8)11-6/h2-3,5H,4H2,1H3
InChI Key:
CSWWRZWXONWRKU-UHFFFAOYSA-N
SMILES:
ClCc1ccc2n(c1)nc(n2)C
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.041g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
181.623g/mol
Monoisotopic Mass:
181.041g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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