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182291-88-9 | 2-Pyridinecarbonitrile, 5-(aminomethyl)-, hydrochloride (1:2)
CAS No: 182291-88-9 Catalog No: AG0023LA MDL No:MFCD08457627
Product Description
Catalog Number:
AG0023LA
Chemical Name:
2-Pyridinecarbonitrile, 5-(aminomethyl)-, hydrochloride (1:2)
CAS Number:
182291-88-9
Molecular Formula:
C7H9Cl2N3
Molecular Weight:
206.0725
MDL Number:
MFCD08457627
IUPAC Name:
5-(aminomethyl)pyridine-2-carbonitrile;dihydrochloride
InChI:
InChI=1S/C7H7N3.2ClH/c8-3-6-1-2-7(4-9)10-5-6;;/h1-2,5H,3,8H2;2*1H
InChI Key:
WSSRNNITAOUXBX-UHFFFAOYSA-N
SMILES:
NCc1ccc(nc1)C#N.Cl.Cl
Properties
Complexity:
146
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.017g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
206.07g/mol
Monoisotopic Mass:
205.017g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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