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17172-62-2 | 4-[2-OXO-2-(1-PIPERIDINYL)ETHOXY]BENZALDEHYDE
CAS No: 17172-62-2 Catalog No: AG007WMQ MDL No:MFCD00736237
Product Description
Catalog Number:
AG007WMQ
Chemical Name:
4-[2-OXO-2-(1-PIPERIDINYL)ETHOXY]BENZALDEHYDE
CAS Number:
17172-62-2
Molecular Formula:
C14H17NO3
Molecular Weight:
247.2897
MDL Number:
MFCD00736237
IUPAC Name:
4-(2-oxo-2-piperidin-1-ylethoxy)benzaldehyde
InChI:
InChI=1S/C14H17NO3/c16-10-12-4-6-13(7-5-12)18-11-14(17)15-8-2-1-3-9-15/h4-7,10H,1-3,8-9,11H2
InChI Key:
WSOMRIFBTYVLIY-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)OCC(=O)N1CCCCC1
Properties
Complexity:
279
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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