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Home > Aldehydes > 1695671-05-6
1695671-05-6 | 5-METHYL-2-(PIPERAZIN-1-YL)BENZALDEHYDE
CAS No: 1695671-05-6 Catalog No: AG01C8NF MDL No:MFCD24604347
Product Description
Catalog Number:
AG01C8NF
Chemical Name:
5-METHYL-2-(PIPERAZIN-1-YL)BENZALDEHYDE
CAS Number:
1695671-05-6
Molecular Formula:
C12H16N2O
Molecular Weight:
204.2682
MDL Number:
MFCD24604347
IUPAC Name:
5-methyl-2-piperazin-1-ylbenzaldehyde
InChI:
InChI=1S/C12H16N2O/c1-10-2-3-12(11(8-10)9-15)14-6-4-13-5-7-14/h2-3,8-9,13H,4-7H2,1H3
InChI Key:
PRTPLXUWJAZMLF-UHFFFAOYSA-N
SMILES:
O=Cc1cc(C)ccc1N1CCNCC1
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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