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Home > Aldehydes > 861453-11-4
861453-11-4 | Benzaldehyde,4-methoxy-3-[3-(4-morpholinyl)propoxy]-
CAS No: 861453-11-4 Catalog No: AG008FDA MDL No:
Product Description
Catalog Number:
AG008FDA
Chemical Name:
Benzaldehyde,4-methoxy-3-[3-(4-morpholinyl)propoxy]-
CAS Number:
861453-11-4
Molecular Formula:
C15H21NO4
Molecular Weight:
279.3315
IUPAC Name:
4-methoxy-3-(3-morpholin-4-ylpropoxy)benzaldehyde
InChI:
InChI=1S/C15H21NO4/c1-18-14-4-3-13(12-17)11-15(14)20-8-2-5-16-6-9-19-10-7-16/h3-4,11-12H,2,5-10H2,1H3
InChI Key:
QXZARGFWSXUFKK-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1OCCCN1CCOCC1)C=O
Properties
Complexity:
281
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.147g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.336g/mol
Monoisotopic Mass:
279.147g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
48A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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