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700856-08-2 | 3-[4-(4-MORPHOLINYL)BUTOXY]BENZALDEHYDE
CAS No: 700856-08-2 Catalog No: AG0063TQ MDL No:MFCD05987353
Product Description
Catalog Number:
AG0063TQ
Chemical Name:
3-[4-(4-MORPHOLINYL)BUTOXY]BENZALDEHYDE
CAS Number:
700856-08-2
Molecular Formula:
C15H21NO3
Molecular Weight:
263.3321
MDL Number:
MFCD05987353
IUPAC Name:
3-(4-morpholin-4-ylbutoxy)benzaldehyde
InChI:
InChI=1S/C15H21NO3/c17-13-14-4-3-5-15(12-14)19-9-2-1-6-16-7-10-18-11-8-16/h3-5,12-13H,1-2,6-11H2
InChI Key:
JPBYHDPTVUREPQ-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)OCCCCN1CCOCC1
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.152g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.337g/mol
Monoisotopic Mass:
263.152g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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