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883546-90-5

883546-90-5 | 3-Methoxy-2-(3-piperidin-1-yl-propoxy)-benzaldehyde

CAS No: 883546-90-5 Catalog No: AG01EY6W MDL No:

Product Description

Catalog Number:
AG01EY6W
Chemical Name:
3-Methoxy-2-(3-piperidin-1-yl-propoxy)-benzaldehyde
CAS Number:
883546-90-5
Molecular Formula:
C16H23NO3
Molecular Weight:
277.3587
IUPAC Name:
3-methoxy-2-(3-piperidin-1-ylpropoxy)benzaldehyde
InChI:
InChI=1S/C16H23NO3/c1-19-15-8-5-7-14(13-18)16(15)20-12-6-11-17-9-3-2-4-10-17/h5,7-8,13H,2-4,6,9-12H2,1H3
InChI Key:
KVLICRGBHHHQBZ-UHFFFAOYSA-N
SMILES:
COc1cccc(c1OCCCN1CCCCC1)C=O

Properties

Complexity:
279  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.168g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
277.364g/mol
Monoisotopic Mass:
277.168g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  

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