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820237-88-5 | Morpholine, 4-[5-(6-formyl-2-methyl-3-propoxyphenoxy)-1-oxopentyl]-
CAS No: 820237-88-5 Catalog No: AG0053C4 MDL No:
Product Description
Catalog Number:
AG0053C4
Chemical Name:
Morpholine, 4-[5-(6-formyl-2-methyl-3-propoxyphenoxy)-1-oxopentyl]-
CAS Number:
820237-88-5
Molecular Formula:
C20H29NO5
Molecular Weight:
363.4480
IUPAC Name:
3-methyl-2-(5-morpholin-4-yl-5-oxopentoxy)-4-propoxybenzaldehyde
InChI:
InChI=1S/C20H29NO5/c1-3-11-25-18-8-7-17(15-22)20(16(18)2)26-12-5-4-6-19(23)21-9-13-24-14-10-21/h7-8,15H,3-6,9-14H2,1-2H3
InChI Key:
WUDNQRKVOJCJJO-UHFFFAOYSA-N
SMILES:
CCCOc1ccc(c(c1C)OCCCCC(=O)N1CCOCC1)C=O
Properties
Complexity:
424
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
363.205g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
363.454g/mol
Monoisotopic Mass:
363.205g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
65.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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