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AC-ALA-PNA

CAS No.:
35978-75-7
Catalog Number:
AG00CHQL
Molecular Formula:
C11H13N3O4
Molecular Weight:
251.2386
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Product Description
Catalog Number:
AG00CHQL
Chemical Name:
AC-ALA-PNA
CAS Number:
35978-75-7
Molecular Formula:
C11H13N3O4
Molecular Weight:
251.2386
MDL Number:
MFCD00057754
IUPAC Name:
(2S)-2-acetamido-N-(4-nitrophenyl)propanamide
InChI:
InChI=1S/C11H13N3O4/c1-7(12-8(2)15)11(16)13-9-3-5-10(6-4-9)14(17)18/h3-7H,1-2H3,(H,12,15)(H,13,16)/t7-/m0/s1
InChI Key:
ABYZSYDGJGVCHS-ZETCQYMHSA-N
SMILES:
CC(=O)N[C@H](C(=O)Nc1ccc(cc1)[N+](=O)[O-])C
Properties
Complexity:
332  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
251.091g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
251.242g/mol
Monoisotopic Mass:
251.091g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Literature
Title Journal
Acyl peptide hydrolase degrades monomeric and oligomeric amyloid-beta peptide. Molecular neurodegeneration 20090101
Properties