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2473-39-4 | Piperidinium, 1-[5-(1-piperidinyl)-2,4-pentadien-1-ylidene]-, perchlorate (1:1)
CAS No: 2473-39-4 Catalog No: AG002P9M MDL No:
Product Description
Catalog Number:
AG002P9M
Chemical Name:
Piperidinium, 1-[5-(1-piperidinyl)-2,4-pentadien-1-ylidene]-, perchlorate (1:1)
CAS Number:
2473-39-4
Molecular Formula:
C15H25ClN2O4
Molecular Weight:
332.8230
IUPAC Name:
1-(5-piperidin-1-ium-1-ylidenepenta-1,3-dienyl)piperidine;perchlorate
InChI:
InChI=1S/C15H25N2.ClHO4/c1-4-10-16(11-5-1)14-8-3-9-15-17-12-6-2-7-13-17;2-1(3,4)5/h3,8-9,14-15H,1-2,4-7,10-13H2;(H,2,3,4,5)/q+1;/p-1
InChI Key:
LIKQQYQAJKYFAP-UHFFFAOYSA-M
SMILES:
C1CCN(CC1)C=CC=CC=[N+]1CCCCC1.[O-][Cl](=O)(=O)=O
Properties
Complexity:
356
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
332.15g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
332.825g/mol
Monoisotopic Mass:
332.15g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
80.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
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