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Tert-butyl 4-methyl-7-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1,2,3,4-tetrahydroquinoxaline-1-carboxylate

HCID 123711014
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CN1CCN(C(=O)OC(C)(C)C)c2cc(B3OC(C)(C)C(C)(C)O3)ccc21
InChIKey
NVLRCJMIDPPKAG-UHFFFAOYSA-N
Molecular formula
C20H31BN2O4
Average molar mass
374.3 g/mol

Names & identifiers

Preferred name
Tert-butyl 4-methyl-7-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1,2,3,4-tetrahydroquinoxaline-1-carboxylate
IUPAC
tert-butyl 4-methyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,3-dihydroquinoxaline-1-carboxylate

Names & synonyms

1375301-96-4tert-butyl 4-methyl-7-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1,2,3,4-tetrahydroquinoxaline-1-carboxylatetert-butyl 4-methyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,3-dihydroquinoxaline-1-carboxylatetert-butyl 4-methyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,4-dihydroquinoxaline-1(2H)-carboxylateSCHEMBL16426591NVLRCJMIDPPKAG-UHFFFAOYSA-NNCGC00663096-01EN300-6477778Z2050049838

Database identifiers

PubChem CID
123711014

Properties

Computed structural properties

Topological polar surface area
51.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
27
Formal charge
0
Complexity
559

Related reactions

1 records
New reaction record
HRID 2209122 reaction equation
HRID 2209122As reactantuspto-grants-2016_06

Compound notes

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