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tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5,6-dihydropyridin-1(2H)-carboxylic acid

HCID 67167277
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(C)(C)C1C=C(B2OC(C)(C)C(C)(C)O2)CCN1C(=O)O
InChIKey
LOPNXCUXLDHJOM-UHFFFAOYSA-N
Molecular formula
C16H28BNO4
Average molar mass
309.2 g/mol

Names & identifiers

Preferred name
tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5,6-dihydropyridin-1(2H)-carboxylic acid
IUPAC
6-tert-butyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylic acid

Names & synonyms

SCHEMBL1804491LOPNXCUXLDHJOM-UHFFFAOYSA-Ntert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5,6-dihydropyridin-1 (2H)-carboxylic acidtert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5,6-dihydropyridin-1(2H)-carboxylic acid

Database identifiers

PubChem CID
67167277

Properties

Computed structural properties

Topological polar surface area
59 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
22
Formal charge
0
Complexity
477

Related reactions

2 records
New reaction record
HRID 2208047 reaction equation
HRID 2208047As reactantuspto-grants-2016_06
HRID 2208100 reaction equation
HRID 2208100As reactantuspto-grants-2016_06

Compound notes

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