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1554429-11-6 | 3-CYCLOPROPYL-3H,4H,5H,6H,7H-[1,2,3]TRIAZOLO[4,5-C]PYRIDINE
CAS No: 1554429-11-6 Catalog No: AG01BTC0 MDL No:MFCD26730551
Product Description
Catalog Number:
AG01BTC0
Chemical Name:
3-CYCLOPROPYL-3H,4H,5H,6H,7H-[1,2,3]TRIAZOLO[4,5-C]PYRIDINE
CAS Number:
1554429-11-6
Molecular Formula:
C8H12N4
Molecular Weight:
164.2077
MDL Number:
MFCD26730551
IUPAC Name:
3-cyclopropyl-4,5,6,7-tetrahydrotriazolo[4,5-c]pyridine
InChI:
InChI=1S/C8H12N4/c1-2-6(1)12-8-5-9-4-3-7(8)10-11-12/h6,9H,1-5H2
InChI Key:
NVJJCPKOHPWQFZ-UHFFFAOYSA-N
SMILES:
N1CCc2c(C1)n(nn2)C1CC1
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.106g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
164.212g/mol
Monoisotopic Mass:
164.106g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
42.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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