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Home > Pyridines > 162437-92-5
162437-92-5 | 2-Propyn-1-ol, 3-(6-methoxy-3-pyridazinyl)-
CAS No: 162437-92-5 Catalog No: AG001T62 MDL No:
Product Description
Catalog Number:
AG001T62
Chemical Name:
2-Propyn-1-ol, 3-(6-methoxy-3-pyridazinyl)-
CAS Number:
162437-92-5
Molecular Formula:
C8H8N2O2
Molecular Weight:
164.1613
IUPAC Name:
3-(6-methoxypyridazin-3-yl)prop-2-yn-1-ol
InChI:
InChI=1S/C8H8N2O2/c1-12-8-5-4-7(9-10-8)3-2-6-11/h4-5,11H,6H2,1H3
InChI Key:
PUUQIHBAFRNUMD-UHFFFAOYSA-N
SMILES:
COc1ccc(nn1)C#CCO
Properties
Complexity:
194
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.059g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
164.164g/mol
Monoisotopic Mass:
164.059g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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