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Home > Aldehydes > 147900-77-4
147900-77-4 | 1-Piperazinecarboxaldehyde, 4-methyl-2,5-dioxo-
CAS No: 147900-77-4 Catalog No: AG001F9X MDL No:
Product Description
Catalog Number:
AG001F9X
Chemical Name:
1-Piperazinecarboxaldehyde, 4-methyl-2,5-dioxo-
CAS Number:
147900-77-4
Molecular Formula:
C6H8N2O3
Molecular Weight:
156.1393
IUPAC Name:
4-methyl-2,5-dioxopiperazine-1-carbaldehyde
InChI:
InChI=1S/C6H8N2O3/c1-7-2-6(11)8(4-9)3-5(7)10/h4H,2-3H2,1H3
InChI Key:
BQZLZDGUEQGSBY-UHFFFAOYSA-N
SMILES:
O=CN1CC(=O)N(CC1=O)C
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.053g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.141g/mol
Monoisotopic Mass:
156.053g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
57.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.1
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