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Home > Pyridines > 115849-93-9
115849-93-9 | 3-Pyridinecarbonyl chloride, 6-(octyloxy)-
CAS No: 115849-93-9 Catalog No: AG000GZ3 MDL No:
Product Description
Catalog Number:
AG000GZ3
Chemical Name:
3-Pyridinecarbonyl chloride, 6-(octyloxy)-
CAS Number:
115849-93-9
Molecular Formula:
C14H20ClNO2
Molecular Weight:
269.7671
IUPAC Name:
6-octoxypyridine-3-carbonyl chloride
InChI:
InChI=1S/C14H20ClNO2/c1-2-3-4-5-6-7-10-18-13-9-8-12(11-16-13)14(15)17/h8-9,11H,2-7,10H2,1H3
InChI Key:
PFIQMYVWHZUBGI-UHFFFAOYSA-N
SMILES:
CCCCCCCCOc1ccc(cn1)C(=O)Cl
Properties
Complexity:
236
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.118g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.769g/mol
Monoisotopic Mass:
269.118g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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