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733758-57-1 | 3-METHYL-4,5,6,7-TETRAHYDRO-3H-[1,2,3]TRIAZOLO[4,5-C]PYRIDINE
CAS No: 733758-57-1 Catalog No: AG01BTBZ MDL No:MFCD22548140
Product Description
Catalog Number:
AG01BTBZ
Chemical Name:
3-METHYL-4,5,6,7-TETRAHYDRO-3H-[1,2,3]TRIAZOLO[4,5-C]PYRIDINE
CAS Number:
733758-57-1
Molecular Formula:
C6H10N4
Molecular Weight:
138.1704
MDL Number:
MFCD22548140
IUPAC Name:
3-methyl-4,5,6,7-tetrahydrotriazolo[4,5-c]pyridine
InChI:
InChI=1S/C6H10N4/c1-10-6-4-7-3-2-5(6)8-9-10/h7H,2-4H2,1H3
InChI Key:
ROEVJSDXPACVSR-UHFFFAOYSA-N
SMILES:
Cn1nnc2c1CNCC2
Properties
Complexity:
127
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.091g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
138.174g/mol
Monoisotopic Mass:
138.091g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
42.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8
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