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73840-35-4 | 2-(2-PIPERIDIN-1-YLETHYL)PYRIDINE DIHYDRIODIDE
CAS No: 73840-35-4 Catalog No: AG005KBD MDL No:
Product Description
Catalog Number:
AG005KBD
Chemical Name:
2-(2-PIPERIDIN-1-YLETHYL)PYRIDINE DIHYDRIODIDE
CAS Number:
73840-35-4
Molecular Formula:
C12H20I2N2
Molecular Weight:
446.1095
IUPAC Name:
2-(2-piperidin-1-ylethyl)pyridine;dihydroiodide
InChI:
InChI=1S/C12H18N2.2HI/c1-4-9-14(10-5-1)11-7-12-6-2-3-8-13-12;;/h2-3,6,8H,1,4-5,7,9-11H2;2*1H
InChI Key:
LLHHKBKRVWVAIX-UHFFFAOYSA-N
SMILES:
C1CCN(CC1)CCc1ccccn1.I.I
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
445.972g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
446.115g/mol
Monoisotopic Mass:
445.972g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
16.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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