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Home > Aldehydes > 887588-94-5
887588-94-5 | 1-Piperazineacetaldehyde,4-methyl-
CAS No: 887588-94-5 Catalog No: AG004BCR MDL No:
Product Description
Catalog Number:
AG004BCR
Chemical Name:
1-Piperazineacetaldehyde,4-methyl-
CAS Number:
887588-94-5
Molecular Formula:
C7H14N2O
Molecular Weight:
142.1989
IUPAC Name:
2-(4-methylpiperazin-1-yl)acetaldehyde
InChI:
InChI=1S/C7H14N2O/c1-8-2-4-9(5-3-8)6-7-10/h7H,2-6H2,1H3
InChI Key:
HTALWDRNRKAFMF-UHFFFAOYSA-N
SMILES:
O=CCN1CCN(CC1)C
Properties
Complexity:
108
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.111g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
142.202g/mol
Monoisotopic Mass:
142.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
23.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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