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18205-56-6 | 4-Pyridinemethanamine, hydrochloride (1:2)
CAS No: 18205-56-6 Catalog No: AG0023AB MDL No:
Product Description
Catalog Number:
AG0023AB
Chemical Name:
4-Pyridinemethanamine, hydrochloride (1:2)
CAS Number:
18205-56-6
Molecular Formula:
C6H10Cl2N2
Molecular Weight:
181.0630
IUPAC Name:
pyridin-4-ylmethanamine;dihydrochloride
InChI:
InChI=1S/C6H8N2.2ClH/c7-5-6-1-3-8-4-2-6;;/h1-4H,5,7H2;2*1H
InChI Key:
VZTITPMLZPPLRB-UHFFFAOYSA-N
SMILES:
NCc1ccncc1.Cl.Cl
Properties
Complexity:
57.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.022g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
181.06g/mol
Monoisotopic Mass:
180.022g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
| Title | Journal |
|---|---|
| Alkylamino derivatives of 4-aminomethylpyridine as inhibitors of copper-containing amine oxidases. | Journal of medicinal chemistry 20050210 |
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