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N2-(Ethoxycarbonyl)-L-glutamine

HCID 12182829
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Basic information

CAS
19887-33-3
Standard SMILES
CCOC(=O)N[C@@H](CCC(N)=O)C(=O)O
InChIKey
QVDBDPOICYJROR-YFKPBYRVSA-N
Molecular formula
C8H14N2O5
Average molar mass
218.21 g/mol
Monoisotopic mass
218.09027155

Names & identifiers

Preferred name
N2-(Ethoxycarbonyl)-L-glutamine
IUPAC
(2S)-5-amino-2-(ethoxycarbonylamino)-5-oxopentanoic acid

Names & synonyms

N2-(Ethoxycarbonyl)-L-glutamineDTXSID001304744N~2~-(Ethoxycarbonyl)-L-glutamine19887-33-3

Database identifiers

CAS
19887-33-3
PubChem CID
12182829
DTXSID
DTXSID001304744

Properties

Computed structural properties

XLogP
-0.9
Topological polar surface area
119 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
5
Rotatable bonds
7
Heavy atoms
15
Formal charge
0
Complexity
253

Related reactions

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Compound notes

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