Home Aldehydes 100875-69-2
100875-69-2,MFCD07801106
Catalog No.:AA00030Q
100875-69-2 | 4-(2-(4-Methylpiperazin-1-yl)ethoxy)benzaldehyde
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500mg
2 weeks  
$634.00   $444.00
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Technical Information
Catalog Number:
AA00030Q
Chemical Name:
4-(2-(4-Methylpiperazin-1-yl)ethoxy)benzaldehyde
CAS Number:
100875-69-2
Molecular Formula:
C14H20N2O2
Molecular Weight:
248.3208
MDL Number:
MFCD07801106
IUPAC Name:
4-[2-(4-methylpiperazin-1-yl)ethoxy]benzaldehyde
InChI:
InChI=1S/C14H20N2O2/c1-15-6-8-16(9-7-15)10-11-18-14-4-2-13(12-17)3-5-14/h2-5,12H,6-11H2,1H3
InChI Key:
AGAKHJJMBZUXKF-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)OCCN1CCN(CC1)C
Properties
Computed Properties
 
Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.152g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.326g/mol
Monoisotopic Mass:
248.152g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
32.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  

Synonyms
 
100875-69-2 
4-[2-(4-Methyl-piperazin-1-yl)-ethoxy]-benzaldehyde 
DTXSID70359633 
AGAKHJJMBZUXKF-UHFFFAOYSA-N 
7285AC 
SBB011911 
ZINC19735684 
AKOS000103123 
MCULE-1972707931 
UPCMLD0ENAT5771839:001 
TR-044833 
FT-0677832 
4-(2-(4-Methylpiperazin-1-yl)ethoxy)benzaldehyde 
ST50321120 
Z-0385 
I01-14477 
C14H20N2O2 
CID976975 
4-[2-(4-methylpiperazin-1-yl)ethoxy]benzaldehyde 
4-[2-(4-methylpiperazinyl)ethoxy]benzaldehyde 
BAS 09892767 
AC1LJNL0 
4-[2-(4-Methylpiperazin-1-yl)-ethoxy]-benzaldehyde 
SCHEMBL5217666 
CTK7H9548 
Literature
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