Home Aminos 3-[(pyridin-3-ylmethyl)amino]propanoic acid dihydrochloride

3-[(pyridin-3-ylmethyl)amino]propanoic acid dihydrochloride

CAS No.:
1251923-50-8
Catalog Number:
AG01A9YA
Molecular Formula:
C9H14Cl2N2O2
Molecular Weight:
253.1257
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Product Description
Catalog Number:
AG01A9YA
Chemical Name:
3-[(pyridin-3-ylmethyl)amino]propanoic acid dihydrochloride
CAS Number:
1251923-50-8
Molecular Formula:
C9H14Cl2N2O2
Molecular Weight:
253.1257
MDL Number:
MFCD16817492
IUPAC Name:
3-(pyridin-3-ylmethylamino)propanoic acid;dihydrochloride
InChI:
InChI=1S/C9H12N2O2.2ClH/c12-9(13)3-5-11-7-8-2-1-4-10-6-8;;/h1-2,4,6,11H,3,5,7H2,(H,12,13);2*1H
InChI Key:
SHZQGUIRDCBUSU-UHFFFAOYSA-N
SMILES:
OC(=O)CCNCc1cccnc1.Cl.Cl
Properties
Complexity:
162  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.043g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
253.123g/mol
Monoisotopic Mass:
252.043g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
62.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties