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848847-23-4

848847-23-4 | Benzaldehyde, 2-chloro-4-[3-(4-methyl-1-piperazinyl)propoxy]-

CAS No: 848847-23-4 Catalog No: AG004M9A MDL No:

Product Description

Catalog Number:
AG004M9A
Chemical Name:
Benzaldehyde, 2-chloro-4-[3-(4-methyl-1-piperazinyl)propoxy]-
CAS Number:
848847-23-4
Molecular Formula:
C15H21ClN2O2
Molecular Weight:
296.7924
IUPAC Name:
2-chloro-4-[3-(4-methylpiperazin-1-yl)propoxy]benzaldehyde
InChI:
InChI=1S/C15H21ClN2O2/c1-17-6-8-18(9-7-17)5-2-10-20-14-4-3-13(12-19)15(16)11-14/h3-4,11-12H,2,5-10H2,1H3
InChI Key:
NZDMPBWPKREDSF-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1Cl)OCCCN1CCN(CC1)C

Properties

Complexity:
296  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.129g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
296.795g/mol
Monoisotopic Mass:
296.129g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
32.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

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