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287111-68-6 | C-Phenyl-C-pyridin-3-yl-methylamine dihydrochloride
CAS No: 287111-68-6 Catalog No: AG01F8VK MDL No:
Product Description
Catalog Number:
AG01F8VK
Chemical Name:
C-Phenyl-C-pyridin-3-yl-methylamine dihydrochloride
CAS Number:
287111-68-6
Molecular Formula:
C12H14Cl2N2
Molecular Weight:
257.1590
IUPAC Name:
phenyl(pyridin-3-yl)methanamine;dihydrochloride
InChI:
InChI=1S/C12H12N2.2ClH/c13-12(10-5-2-1-3-6-10)11-7-4-8-14-9-11;;/h1-9,12H,13H2;2*1H
InChI Key:
HRPXEYCURFOBKY-UHFFFAOYSA-N
SMILES:
NC(c1cccnc1)c1ccccc1.Cl.Cl
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.053g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
257.158g/mol
Monoisotopic Mass:
256.053g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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