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130289-49-5 | L-Glutamic acid, N-(1-oxo-4-phenylbutyl)-
CAS No: 130289-49-5 Catalog No: AG000U7T MDL No:
Product Description
Catalog Number:
AG000U7T
Chemical Name:
L-Glutamic acid, N-(1-oxo-4-phenylbutyl)-
CAS Number:
130289-49-5
Molecular Formula:
C15H19NO5
Molecular Weight:
293.3151
IUPAC Name:
2-(4-phenylbutanoylamino)pentanedioic acid
InChI:
InChI=1S/C15H19NO5/c17-13(8-4-7-11-5-2-1-3-6-11)16-12(15(20)21)9-10-14(18)19/h1-3,5-6,12H,4,7-10H2,(H,16,17)(H,18,19)(H,20,21)
InChI Key:
IQJMRUKANJFLSY-UHFFFAOYSA-N
SMILES:
O=C(N[C@H](C(=O)O)CCC(=O)O)CCCc1ccccc1
Properties
Complexity:
363
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.126g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
293.319g/mol
Monoisotopic Mass:
293.126g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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