Home Aminos 4-amino-3-(pyridin-4-yl)butanoic acid dihydrochloride

4-amino-3-(pyridin-4-yl)butanoic acid dihydrochloride

CAS No.:
2137852-23-2
Catalog Number:
AG01ELLV
Molecular Formula:
C9H14Cl2N2O2
Molecular Weight:
253.1257
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Product Description
Catalog Number:
AG01ELLV
Chemical Name:
4-amino-3-(pyridin-4-yl)butanoic acid dihydrochloride
CAS Number:
2137852-23-2
Molecular Formula:
C9H14Cl2N2O2
Molecular Weight:
253.1257
MDL Number:
MFCD31439571
IUPAC Name:
4-amino-3-pyridin-4-ylbutanoic acid;dihydrochloride
InChI:
InChI=1S/C9H12N2O2.2ClH/c10-6-8(5-9(12)13)7-1-3-11-4-2-7;;/h1-4,8H,5-6,10H2,(H,12,13);2*1H
InChI Key:
RVPVAAWXDGZIBM-UHFFFAOYSA-N
SMILES:
NCC(c1ccncc1)CC(=O)O.Cl.Cl
Properties
Complexity:
167  
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:
4  
Topological Polar Surface Area:
76.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties