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Home > Aldehydes > 125418-89-5
125418-89-5 | Benzaldehyde, 2-[2-oxo-2-(1-piperidinyl)ethoxy]-
CAS No: 125418-89-5 Catalog No: AG000NOK MDL No:MFCD08691969
Product Description
Catalog Number:
AG000NOK
Chemical Name:
Benzaldehyde, 2-[2-oxo-2-(1-piperidinyl)ethoxy]-
CAS Number:
125418-89-5
Molecular Formula:
C14H17NO3
Molecular Weight:
247.2897
MDL Number:
MFCD08691969
IUPAC Name:
2-(2-oxo-2-piperidin-1-ylethoxy)benzaldehyde
InChI:
InChI=1S/C14H17NO3/c16-10-12-6-2-3-7-13(12)18-11-14(17)15-8-4-1-5-9-15/h2-3,6-7,10H,1,4-5,8-9,11H2
InChI Key:
KHYZSSDWPPTXEK-UHFFFAOYSA-N
SMILES:
O=Cc1ccccc1OCC(=O)N1CCCCC1
Properties
Complexity:
287
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.121g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.294g/mol
Monoisotopic Mass:
247.121g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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