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4122-84-3 | 4-(2-hydroxy-3-(1-piperidinyl)propyl)-1-piperazinecarbaldehyde
CAS No: 4122-84-3 Catalog No: AG0072UL MDL No:
Product Description
Catalog Number:
AG0072UL
Chemical Name:
4-(2-hydroxy-3-(1-piperidinyl)propyl)-1-piperazinecarbaldehyde
CAS Number:
4122-84-3
Molecular Formula:
C13H25N3O2
Molecular Weight:
255.3565
IUPAC Name:
4-(2-hydroxy-3-piperidin-1-ylpropyl)piperazine-1-carbaldehyde
InChI:
InChI=1S/C13H25N3O2/c17-12-16-8-6-15(7-9-16)11-13(18)10-14-4-2-1-3-5-14/h12-13,18H,1-11H2
InChI Key:
GAUYDPLFKRENDX-UHFFFAOYSA-N
SMILES:
O=CN1CCN(CC1)CC(CN1CCCCC1)O
NSC Number:
62380
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.195g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
255.362g/mol
Monoisotopic Mass:
255.195g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
47A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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