CAS
4426-47-5 Purity
99.5%+
4426-47-5 Purity
99.5%+
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2-Chloro-5-fluorobenzeneboronic acid
CAS
444666-39-1
Catalog Number
ACM444666391
Category
Boronic Acids
Molecular Weight
174.36
Molecular Formula
C6H5BClFO2
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Specification
Synonyms
2-chloro-5-fluorophenylboronic acid, 2-Chloro-5-fluorobenzeneboronic acid, 444666-39-1, 2-Chloro-5-fluorobenzeneboronicacid, AG-F-56084, SureCN4836, ACMC-1AQT7, KSC494A1H, AC1Q713B, CTK3J4013, MolPort-000-165-517, ACT11075, ANW-30125, PC1631, SBB088951, 2-Chloro-5-fluorophenylboronic acid,, (2-chloro-5-fluorophenyl)boronic acid, 2-Chloro-5-Fluorophenyl-Boronic Acid, AKOS006221388, AB25503
IUPAC Name
(2-chloro-5-fluorophenyl)boronic acid
Canonical SMILES
B(C1=C(C=CC(=C1)F)Cl)(O)O
InChI Key
OVTZJDSREVDCTJ-UHFFFAOYSA-N
Boiling Point
309.1ºC at 760 mmHg
Melting Point
78-82ºC
Flash Point
140.7ºC
Density
1.41 g/cm³
Exact Mass
174.00600
Hazard Statements
Xi: Irritant;
H-Bond Acceptor
3
H-Bond Donor
2
Safety Description
26-36
What is the molecular formula of 2-Chloro-5-fluorobenzeneboronic acid?
The molecular formula of 2-Chloro-5-fluorobenzeneboronic acid is C6H5BClFO2.
What is the molecular weight of 2-Chloro-5-fluorobenzeneboronic acid?
The molecular weight of 2-Chloro-5-fluorobenzeneboronic acid is 174.37 g/mol.
What is the IUPAC name of 2-Chloro-5-fluorobenzeneboronic acid?
The IUPAC name of 2-Chloro-5-fluorobenzeneboronic acid is (2-chloro-5-fluorophenyl)boronic acid.
What is the InChI of 2-Chloro-5-fluorobenzeneboronic acid?
The InChI of 2-Chloro-5-fluorobenzeneboronic acid is InChI=1S/C6H5BClFO2/c8-6-2-1-4(9)3-5(6)7(10)11/h1-3,10-11H.
What is the InChIKey of 2-Chloro-5-fluorobenzeneboronic acid?
The InChIKey of 2-Chloro-5-fluorobenzeneboronic acid is OVTZJDSREVDCTJ-UHFFFAOYSA-N.
What is the canonical SMILES of 2-Chloro-5-fluorobenzeneboronic acid?
The canonical SMILES of 2-Chloro-5-fluorobenzeneboronic acid is B(C1=C(C=CC(=C1)F)Cl)(O)O.
What is the CAS number of 2-Chloro-5-fluorobenzeneboronic acid?
The CAS number of 2-Chloro-5-fluorobenzeneboronic acid is 444666-39-1.
What is the EPA DSSTox Substance ID of 2-Chloro-5-fluorobenzeneboronic acid?
The EPA DSSTox Substance ID of 2-Chloro-5-fluorobenzeneboronic acid is DTXSID60627318.
Is 2-Chloro-5-fluorobenzeneboronic acid canonicalized?
Yes, 2-Chloro-5-fluorobenzeneboronic acid is canonicalized.
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