Home Other Building Blocks 2-(2-phenylacetamido)pentanoic acid

2-(2-phenylacetamido)pentanoic acid

CAS No.:
65415-01-2
Catalog Number:
AG01AHO9
Molecular Formula:
C13H17NO3
Molecular Weight:
235.2790
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Product Description
Catalog Number:
AG01AHO9
Chemical Name:
2-(2-phenylacetamido)pentanoic acid
CAS Number:
65415-01-2
Molecular Formula:
C13H17NO3
Molecular Weight:
235.2790
MDL Number:
MFCD12096975
IUPAC Name:
2-[(2-phenylacetyl)amino]pentanoic acid
InChI:
InChI=1S/C13H17NO3/c1-2-6-11(13(16)17)14-12(15)9-10-7-4-3-5-8-10/h3-5,7-8,11H,2,6,9H2,1H3,(H,14,15)(H,16,17)
InChI Key:
KTTWUNXJQQFZLT-UHFFFAOYSA-N
SMILES:
CCCC(C(=O)O)NC(=O)Cc1ccccc1
Properties
Complexity:
259  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.121g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
235.283g/mol
Monoisotopic Mass:
235.121g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties