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Home > Aldehydes > 1409787-47-8
1409787-47-8 | 2-METHYL-4-(PIPERAZIN-1-YL)BENZALDEHYDE
CAS No: 1409787-47-8 Catalog No: AG01C8LJ MDL No:MFCD20300398
Product Description
Catalog Number:
AG01C8LJ
Chemical Name:
2-METHYL-4-(PIPERAZIN-1-YL)BENZALDEHYDE
CAS Number:
1409787-47-8
Molecular Formula:
C12H16N2O
Molecular Weight:
204.2682
MDL Number:
MFCD20300398
IUPAC Name:
2-methyl-4-piperazin-1-ylbenzaldehyde
InChI:
InChI=1S/C12H16N2O/c1-10-8-12(3-2-11(10)9-15)14-6-4-13-5-7-14/h2-3,8-9,13H,4-7H2,1H3
InChI Key:
RLLTYTHKXAWUMO-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1C)N1CCNCC1
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.126g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
204.273g/mol
Monoisotopic Mass:
204.126g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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