Home Aminos 3-Pyridinebutanoicacid, b-amino-, (bR)-

3-Pyridinebutanoicacid, b-amino-, (bR)-

CAS No.:
269396-64-7
Catalog Number:
AG00I53I
Molecular Formula:
C9H14Cl2N2O2
Molecular Weight:
253.1257
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Product Description
Catalog Number:
AG00I53I
Chemical Name:
3-Pyridinebutanoicacid, b-amino-, (bR)-
CAS Number:
269396-64-7
Molecular Formula:
C9H14Cl2N2O2
Molecular Weight:
253.1257
IUPAC Name:
(3R)-3-amino-4-pyridin-3-ylbutanoic acid;dihydrochloride
InChI:
InChI=1S/C9H12N2O2.2ClH/c10-8(5-9(12)13)4-7-2-1-3-11-6-7;;/h1-3,6,8H,4-5,10H2,(H,12,13);2*1H/t8-;;/m1../s1
InChI Key:
JOYZJLGIWVGPRK-YCBDHFTFSA-N
SMILES:
N[C@H](Cc1cccnc1)CC(=O)O.Cl.Cl
Properties
Complexity:
173  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
1  
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:
0
Undefined Bond Stereocenter Count:
0
Properties