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N-(tert-butoxycarbonyl)-N-(2-methylprop-2-enyl)glycine tert-butyl ester

HCID 18316043
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
C=C(C)CN(CC(=O)OC(C)(C)C)C(=O)OC(C)(C)C
InChIKey
RQWWNJACKPTRPV-UHFFFAOYSA-N
Molecular formula
C15H27NO4
Average molar mass
285.38 g/mol

Names & identifiers

Preferred name
N-(tert-butoxycarbonyl)-N-(2-methylprop-2-enyl)glycine tert-butyl ester
IUPAC
tert-butyl 2-[(2-methylpropan-2-yl)oxycarbonyl-(2-methylprop-2-enyl)amino]acetate

Names & synonyms

SCHEMBL7117687RQWWNJACKPTRPV-UHFFFAOYSA-NN-(tert-butoxycarbonyl)-N-(2-methylprop-2-enyl)glycine tert-butyl ester

Database identifiers

PubChem CID
18316043

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
55.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
8
Heavy atoms
20
Formal charge
0
Complexity
374

Related reactions

5 records
New reaction record
HRID 107071 reaction equation
HRID 107071As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 276270 reaction equation
HRID 276270As productuspto-grants-2002_03
HRID 276271 reaction equation
HRID 276271As reactantuspto-grants-2002_03
HRID 276687 reaction equation
HRID 276687As productuspto-grants-2002_03
HRID 310191 reaction equation
HRID 310191As productTraining data from https://doi.org/10.1039/C8SC04228D (8/10)

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes