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Structure

6-(4-Fluorophenyl)pyridine-3-boronicacidpinacolester

CAS
1073354-81-0
Catalog Number
ACM1073354810
Category
Boronic Esters
Molecular Weight
299.1476632
Molecular Formula
C17H19BFNO2

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Specification

Synonyms
1073354-81-0, 6-(4-Fluorophenyl)pyridine-3-boronic acid pinacol ester, 2-(4-FLUOROPHENYL)-5-(4,4,5,5-TETRAMETHYL-[1,3,2]-DIOXABOROLAN-2-YL)PYRIDINE, CTK8A9168, MolPort-002-054-860, ANW-15773, AKOS005259369, AK-94640, BD231523, KB-44266, A-4832, 6-(4-Fluorophenyl)pyridine-3-boronic acid pinacol ester,, 2-(4-Fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
IUPAC Name
2-(4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
InChI Key
CTCLIEHCPOJNSW-UHFFFAOYSA-N
Boiling Point
402.5ºC at 760 mmHg
Flash Point
197.2ºC
Density
1.14g/cm³
Exact Mass
299.14900
H-Bond Acceptor
4
H-Bond Donor
0
What is the molecular formula of the compound?

The molecular formula of the compound is C17H19BFNO2.

What is the molecular weight of the compound?

The molecular weight of the compound is 299.1 g/mol.

What is the IUPAC name of the compound?

The IUPAC name of the compound is 2-(4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine.

What is the InChI of the compound?

The InChI of the compound is InChI=1S/C17H19BFNO2/c1-16(2)17(3,4)22-18(21-16)13-7-10-15(20-11-13)12-5-8-14(19)9-6-12/h5-11H,1-4H3.

What is the InChIKey of the compound?

The InChIKey of the compound is CTCLIEHCPOJNSW-UHFFFAOYSA-N.

What is the canonical SMILES of the compound?

The canonical SMILES of the compound is B1(OC(C(O1)(C)C)(C)C)C2=CN=C(C=C2)C3=CC=C(C=C3)F.

What is the CAS number of the compound?

The CAS number of the compound is 1073354-81-0.

What is the European Community (EC) number of the compound?

The European Community (EC) number of the compound is 681-250-3.

What is the hydrogen bond donor count of the compound?

The hydrogen bond donor count of the compound is 0.

Is the compound canonicalized?

Yes, the compound is canonicalized.

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