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2-(t-butoxycarbonyl)ethyl 5-(Boc-amino)-4-oxopentanoate

HCID 90034512
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(C)(C)OC(=O)CCOC(=O)CCC(=O)CNC(=O)OC(C)(C)C
InChIKey
MSXOJLNOADQAHF-UHFFFAOYSA-N
Molecular formula
C17H29NO7
Average molar mass
359.4 g/mol

Names & identifiers

Preferred name
2-(t-butoxycarbonyl)ethyl 5-(Boc-amino)-4-oxopentanoate
IUPAC
[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl] 5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoate

Names & synonyms

SCHEMBL15561338MSXOJLNOADQAHF-UHFFFAOYSA-N2-(t-butoxycarbonyl)ethyl 5-(Boc-amino)-4-oxopentanoate

Database identifiers

PubChem CID
90034512

Properties

Computed structural properties

XLogP
1.2
Topological polar surface area
108 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
13
Heavy atoms
25
Formal charge
0
Complexity
486

Related reactions

2 records
New reaction record
HRID 1771030 reaction equation
HRID 1771030As productuspto-grants-2016_02
HRID 1771031 reaction equation
HRID 1771031As reactantuspto-grants-2016_02

Compound notes

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