Home Aminos 3-methyl-2-[(pyridin-2-ylmethyl)amino]butanoic acid dihydrochloride

3-methyl-2-[(pyridin-2-ylmethyl)amino]butanoic acid dihydrochloride

CAS No.:
1396965-89-1
Catalog Number:
AG019UM7
Molecular Formula:
C11H18Cl2N2O2
Molecular Weight:
281.1788
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Product Description
Catalog Number:
AG019UM7
Chemical Name:
3-methyl-2-[(pyridin-2-ylmethyl)amino]butanoic acid dihydrochloride
CAS Number:
1396965-89-1
Molecular Formula:
C11H18Cl2N2O2
Molecular Weight:
281.1788
MDL Number:
MFCD11798836
IUPAC Name:
3-methyl-2-(pyridin-2-ylmethylamino)butanoic acid;dihydrochloride
InChI:
InChI=1S/C11H16N2O2.2ClH/c1-8(2)10(11(14)15)13-7-9-5-3-4-6-12-9;;/h3-6,8,10,13H,7H2,1-2H3,(H,14,15);2*1H
InChI Key:
KMOGTWVIDSEYRW-UHFFFAOYSA-N
SMILES:
CC(C(C(=O)O)NCc1ccccn1)C.Cl.Cl
Properties
Complexity:
207  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.075g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
281.177g/mol
Monoisotopic Mass:
280.075g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
62.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties