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Structure

3,5-Dichlorophenylboronic acid, pinacol ester

CAS
68716-51-8
Catalog Number
ACM68716518
Category
Boronic Esters
Molecular Weight
272.96
Molecular Formula
C12H15BCl2O2

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Specification

Synonyms
BM291, 3,5-Dichlorophenylboronic acid pinacol ester, 68716-51-8
IUPAC Name
2-(3,5-dichlorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Canonical SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC(=C2)Cl)Cl
InChI Key
HKSNHZBPIBSVGI-UHFFFAOYSA-N
Boiling Point
351.1ºC at 760 mmHg
Flash Point
166.1ºC
Density
1.2g/cm³
Exact Mass
272.05400
H-Bond Acceptor
2
H-Bond Donor
0
What is the molecular formula of 3,5-Dichlorophenylboronic acid pinacol ester?

The molecular formula of 3,5-Dichlorophenylboronic acid pinacol ester is C12H15BCl2O2.

What is the molecular weight of 3,5-Dichlorophenylboronic acid pinacol ester?

The molecular weight of 3,5-Dichlorophenylboronic acid pinacol ester is 273.0 g/mol.

What is the IUPAC name of 3,5-Dichlorophenylboronic acid pinacol ester?

The IUPAC name of 3,5-Dichlorophenylboronic acid pinacol ester is 2-(3,5-dichlorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane.

What is the InChI of 3,5-Dichlorophenylboronic acid pinacol ester?

The InChI of 3,5-Dichlorophenylboronic acid pinacol ester is InChI=1S/C12H15BCl2O2/c1-11(2)12(3,4)17-13(16-11)8-5-9(14)7-10(15)6-8/h5-7H,1-4H3.

What is the InChIKey of 3,5-Dichlorophenylboronic acid pinacol ester?

The InChIKey of 3,5-Dichlorophenylboronic acid pinacol ester is HKSNHZBPIBSVGI-UHFFFAOYSA-N.

What is the canonical SMILES of 3,5-Dichlorophenylboronic acid pinacol ester?

The canonical SMILES of 3,5-Dichlorophenylboronic acid pinacol ester is B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC(=C2)Cl)Cl.

What is the CAS number of 3,5-Dichlorophenylboronic acid pinacol ester?

The CAS number of 3,5-Dichlorophenylboronic acid pinacol ester is 68716-51-8.

What is the EC number of 3,5-Dichlorophenylboronic acid pinacol ester?

The EC number of 3,5-Dichlorophenylboronic acid pinacol ester is 675-094-5.

What is the DSSTox Substance ID of 3,5-Dichlorophenylboronic acid pinacol ester?

The DSSTox Substance ID of 3,5-Dichlorophenylboronic acid pinacol ester is DTXSID70374220.

Is 3,5-Dichlorophenylboronic acid pinacol ester a canonicalized compound?

Yes, 3,5-Dichlorophenylboronic acid pinacol ester is a canonicalized compound.

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