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N-ethyl-N-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine

HCID 59619611
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Basic information

CAS
1257554-16-7
Standard SMILES
CCN(C)c1ccc(B2OC(C)(C)C(C)(C)O2)cn1
InChIKey
YCCUMCQJXLFVHM-UHFFFAOYSA-N
Molecular formula
C14H23BN2O2
Average molar mass
262.16 g/mol
Monoisotopic mass
262.1852581

Names & identifiers

Preferred name
N-ethyl-N-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine
IUPAC
N-ethyl-N-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine
English name
N-ethyl-N-Methyl-5-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-aMine
Molecular formula
C14H23BN2O2
Molecular weight
262.16

Names & synonyms

1257554-16-7N-ethyl-N-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amineN-Ethyl-N-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinamineYCCUMCQJXLFVHM-UHFFFAOYSA-NMFCD12403458starbld0018606SCHEMBL3514966SCHEMBL31212547DTXSID001136369CS-32227DA-46579A1-23932
Show more names
ethyl(methyl)(5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)pyridin-2-yl)amine2-Pyridinamine, N-ethyl-N-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
2-(Methylethylamino)pyridine-5-boronic acid pinacol ester6-(Ethyl(methyl)amino)pyridine-3-boronic acid pinacol esterethyl-methyl-[5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-pyridin-2-yl]-amine

Database identifiers

CAS
1257554-16-7
PubChem CID
59619611
DTXSID
DTXSID001136369

Properties

Computed structural properties

Topological polar surface area
34.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
19
Formal charge
0
Complexity
307

Physicochemical properties

Boiling point
373 · 373.0±27.0 °C(Predicted)
Density
1.03 · 1.03±0.1 g/cm3(Predicted)
pka
6.95 · 6.95±0.10(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

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Related reactions

2 records
New reaction record
HRID 445659 reaction equation
HRID 445659As reactantuspto-grants-2013_07
HRID 2326405 reaction equation
HRID 2326405As reactantTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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