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Home > Aldehydes > 773866-77-6
773866-77-6 | 2-Piperazinecarboxaldehyde
CAS No: 773866-77-6 Catalog No: AG0053T5 MDL No:
Product Description
Catalog Number:
AG0053T5
Chemical Name:
2-Piperazinecarboxaldehyde
CAS Number:
773866-77-6
Molecular Formula:
C5H10N2O
Molecular Weight:
114.1457
IUPAC Name:
piperazine-2-carbaldehyde
InChI:
InChI=1S/C5H10N2O/c8-4-5-3-6-1-2-7-5/h4-7H,1-3H2
InChI Key:
GJPBJDRVNHKBOO-UHFFFAOYSA-N
SMILES:
C1NCCNC1C=O
Properties
Complexity:
84.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
114.079g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
114.148g/mol
Monoisotopic Mass:
114.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.3
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