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Home > Pyridines > 1187168-93-9
1187168-93-9 | 4-(4-Isopropoxybenzoyl)-2-methylpyridine
CAS No: 1187168-93-9 Catalog No: AG01FBV9 MDL No:
Product Description
Catalog Number:
AG01FBV9
Chemical Name:
4-(4-Isopropoxybenzoyl)-2-methylpyridine
CAS Number:
1187168-93-9
Molecular Formula:
C16H17NO2
Molecular Weight:
255.3117
IUPAC Name:
(2-methylpyridin-4-yl)-(4-propan-2-yloxyphenyl)methanone
InChI:
InChI=1S/C16H17NO2/c1-11(2)19-15-6-4-13(5-7-15)16(18)14-8-9-17-12(3)10-14/h4-11H,1-3H3
InChI Key:
QKXXPMPHCSHOQH-UHFFFAOYSA-N
SMILES:
CC(Oc1ccc(cc1)C(=O)c1ccnc(c1)C)C
Properties
Complexity:
295
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.126g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
255.317g/mol
Monoisotopic Mass:
255.126g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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