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1782-17-8

1782-17-8 | L-Aspartic acid, N-(1-oxohexadecyl)-

CAS No: 1782-17-8 Catalog No: AG0025U6 MDL No:

Product Description

Catalog Number:
AG0025U6
Chemical Name:
L-Aspartic acid, N-(1-oxohexadecyl)-
CAS Number:
1782-17-8
Molecular Formula:
C20H37NO5
Molecular Weight:
371.5115
IUPAC Name:
(2S)-2-(hexadecanoylamino)butanedioic acid
InChI:
InChI=1S/C20H37NO5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(22)21-17(20(25)26)16-19(23)24/h17H,2-16H2,1H3,(H,21,22)(H,23,24)(H,25,26)/t17-/m0/s1
InChI Key:
ZYJZBFYRVKLOAA-KRWDZBQOSA-N
SMILES:
CCCCCCCCCCCCCCCC(=O)N[C@H](C(=O)O)CC(=O)O

Properties

Complexity:
398  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
371.267g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
371.518g/mol
Monoisotopic Mass:
371.267g/mol
Rotatable Bond Count:
18  
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6  

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