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68997-50-2 | 2-[3-(1-PIPERIDINYL)PROPOXY]BENZALDEHYDE
CAS No: 68997-50-2 Catalog No: AG006DUU MDL No:MFCD07440335
Product Description
Catalog Number:
AG006DUU
Chemical Name:
2-[3-(1-PIPERIDINYL)PROPOXY]BENZALDEHYDE
CAS Number:
68997-50-2
Molecular Formula:
C15H21NO2
Molecular Weight:
247.3327
MDL Number:
MFCD07440335
IUPAC Name:
2-(3-piperidin-1-ylpropoxy)benzaldehyde
InChI:
InChI=1S/C15H21NO2/c17-13-14-7-2-3-8-15(14)18-12-6-11-16-9-4-1-5-10-16/h2-3,7-8,13H,1,4-6,9-12H2
InChI Key:
APNWHXAYLQEXJG-UHFFFAOYSA-N
SMILES:
O=Cc1ccccc1OCCCN1CCCCC1
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.157g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.338g/mol
Monoisotopic Mass:
247.157g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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