1H-Indole-2-carboxylic acid,1-[(2S)-2-[[(1S)-1-carboxybutyl]amino]-1-oxopropyl]octahydro-,(2S,3aS,7aS)-


Chemical Name: 1H-Indole-2-carboxylic acid,1-[(2S)-2-[[(1S)-1-carboxybutyl]amino]-1-oxopropyl]octahydro-,(2S,3aS,7aS)-
CAS Number: 95153-31-4
Product Number: AG0066D3(AGN-PC-0W4QP2)
Synonyms:
MDL No: MFCD00865777
Molecular Formula: C17H28N2O5
Molecular Weight: 340.4146

Identification/Properties


Properties
MP:
>125C (dec.)
Storage:
-10 ℃;Keep in dry area;
Form:
Solid
Computed Properties
Molecular Weight:
340.42g/mol
XLogP3:
0.2
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
7
Exact Mass:
340.2g/mol
Monoisotopic Mass:
340.2g/mol
Topological Polar Surface Area:
107A^2
Heavy Atom Count:
24
Formal Charge:
0
Complexity:
495
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
5
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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