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Structure

4-Phenoxyphenylboronic acid

CAS
51067-38-0
Catalog Number
ACM51067380
Category
Main Products
Molecular Weight
214.02
Molecular Formula
C12H11BO3

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Specification

Synonyms
4-PHENOXYBENZENEBORONIC ACID;4-PHENOXYPHENYLBORONIC ACID;AKOS BRN-0132;RARECHEM AH PB 0260;(P-PHENOXYPHENYL)BORONIC ACID;TIMTEC-BB SBB003409;4-Phenoxybenzeneboronic acid 98%;4-Phenoxyphenylboronic acid,97%
IUPAC Name
[4-(phenoxy)phenyl]boronic acid
Canonical SMILES
B(C1=CC=C(C=C1)OC2=CC=CC=C2)(O)O
InChI Key
KFXUHRXGLWUOJT-UHFFFAOYSA-N
Boiling Point
377ºC at 760mmHg
Melting Point
141-145°C(lit.)
Flash Point
181.8ºC
Density
1.23g/cm³
Appearance
white to off-white powder and chunk
Exact Mass
214.08000
Hazard Statements
Xi
H-Bond Acceptor
3
H-Bond Donor
2
Safety Description
37/39-26
Supplemental Hazard Statements
H315-H319-H335
Symbol
GHS07
WGK Germany
3
What is the molecular formula of 4-Phenoxyphenylboronic acid?

The molecular formula of 4-Phenoxyphenylboronic acid is C12H11BO3.

What is the molecular weight of 4-Phenoxyphenylboronic acid?

The molecular weight of 4-Phenoxyphenylboronic acid is 214.03 g/mol.

What is the IUPAC name of 4-Phenoxyphenylboronic acid?

The IUPAC name of 4-Phenoxyphenylboronic acid is (4-phenoxyphenyl)boronic acid.

What is the InChI of 4-Phenoxyphenylboronic acid?

The InChI of 4-Phenoxyphenylboronic acid is InChI=1S/C12H11BO3/c14-13(15)10-6-8-12(9-7-10)16-11-4-2-1-3-5-11/h1-9,14-15H.

What is the InChIKey of 4-Phenoxyphenylboronic acid?

The InChIKey of 4-Phenoxyphenylboronic acid is KFXUHRXGLWUOJT-UHFFFAOYSA-N.

What is the canonical SMILES notation for 4-Phenoxyphenylboronic acid?

The canonical SMILES notation for 4-Phenoxyphenylboronic acid is B(C1=CC=C(C=C1)OC2=CC=CC=C2)(O)O.

What is the CAS number of 4-Phenoxyphenylboronic acid?

The CAS number of 4-Phenoxyphenylboronic acid is 51067-38-0.

What is the European Community (EC) number of 4-Phenoxyphenylboronic acid?

The European Community (EC) number of 4-Phenoxyphenylboronic acid is 687-755-5.

What is the ChEMBL ID of 4-Phenoxyphenylboronic acid?

The ChEMBL ID of 4-Phenoxyphenylboronic acid is CHEMBL459151.

Is 4-Phenoxyphenylboronic acid classified as a compound with a defined atom stereocenter count?

No, 4-Phenoxyphenylboronic acid does not have a defined atom stereocenter count.

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