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Home > Pyridines > 924871-10-3
924871-10-3 | 3-[3-ethoxy-4-(pyridin-4-ylmethoxy)phenyl]prop-2-enoic acid
CAS No: 924871-10-3 Catalog No: AG019Q5V MDL No:MFCD08445232
Product Description
Catalog Number:
AG019Q5V
Chemical Name:
3-[3-ethoxy-4-(pyridin-4-ylmethoxy)phenyl]prop-2-enoic acid
CAS Number:
924871-10-3
Molecular Formula:
C17H17NO4
Molecular Weight:
299.3212
MDL Number:
MFCD08445232
IUPAC Name:
3-[3-ethoxy-4-(pyridin-4-ylmethoxy)phenyl]prop-2-enoic acid
InChI:
InChI=1S/C17H17NO4/c1-2-21-16-11-13(4-6-17(19)20)3-5-15(16)22-12-14-7-9-18-10-8-14/h3-11H,2,12H2,1H3,(H,19,20)
InChI Key:
SXJFSHBDTRILOR-UHFFFAOYSA-N
SMILES:
CCOc1cc(C=CC(=O)O)ccc1OCc1ccncc1
Properties
Complexity:
366
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.116g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
299.326g/mol
Monoisotopic Mass:
299.116g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
68.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.6
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