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tert-Butyl (5-bromo-6-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl)carbamate

HCID 53398552
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Basic information

CAS
1315351-28-0
Standard SMILES
Cc1nc(NC(=O)OC(C)(C)C)c(B2OC(C)(C)C(C)(C)O2)cc1Br
InChIKey
LROLIRRLJWPKIL-UHFFFAOYSA-N
Molecular formula
C17H26BBrN2O4
Average molar mass
413.1 g/mol
Monoisotopic mass
412.1169

Names & identifiers

Preferred name
tert-Butyl (5-bromo-6-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl)carbamate
IUPAC
tert-butyl N-[5-bromo-6-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]carbamate
English name
5-BROMO-2-TERT-BUTYLOXYCARBONYLAMINO-6-METHYLPYRIDINE-3-BORONIC ACID PINACOL ESTER
Molecular formula
C17H26BBrN2O4
Molecular weight
413.11

Names & synonyms

1315351-28-0tert-Butyl (5-bromo-6-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl)carbamate5-Bromo-2-tert-Butyloxycarbonylamino-6-methylpyridine-3-boronic acid pinacol estertert-butyl N-[5-bromo-6-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]carbamateC17H26BBrN2O4tert-Butyl [5-bromo-6-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]carbamateMFCD08063056DTXSID00694504AKOS015950282FD10445tert-butyl N-[5-bromo-6-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridyl]carbamatetert-Butyl(5-bromo-6-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl)carbamate
Show more names
tert-Butyl (5-bromo-6-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl)carbatert-Butyl (5-bromo-6-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl)carbamattert-butylN-[5-bromo-6-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]carbamate
carbamic acid, N-[5-bromo-6-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]-, 1,1-dimethylethyl ester

Properties

Computed structural properties

Topological polar surface area
69.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
25
Formal charge
0
Complexity
493

Physicochemical properties

storage temp.
2 · 2-8°C

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Database identifiers

CAS
1315351-28-0
PubChem CID
53398552
DTXSID
DTXSID00694504