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Structure

3-Ethoxy-5-fluorobenzeneboronic acid

CAS
850589-53-6
Catalog Number
ACM850589536
Category
Boronic Acids
Molecular Weight
183.97
Molecular Formula
C8H10BFO3

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Specification

Synonyms
3-ETHOXY-5-FLUOROPHENYLBORONIC ACID, 850589-53-6, 3-Ethoxy-5-fluorobenzeneboronic acid, SBB071245, AG-H-41343, ACMC-209q3b, SureCN1979081, CTK5F4008, MolPort-001-772-770, ANW-38085, 3-Ethoxy-5-fluorophenylboronic acid,, (3-ethoxy-5-fluorophenyl)boronic acid, AKOS006221616, AB30753, RL05254, AK-40445, KB-31586, (3-ethoxy-5-fluoranyl-phenyl)boronic acid, 5-ETHOXY-3-FLUOROPHENYLBORONIC ACID, Boronic acid,B-(3-ethoxy-5-fluorophenyl)-
IUPAC Name
(3-ethoxy-5-fluorophenyl)boronic acid
Canonical SMILES
B(C1=CC(=CC(=C1)F)OCC)(O)O
InChI Key
OVVBLFYHZAMJIK-UHFFFAOYSA-N
Boiling Point
316.8ºC at 760 mmHg
Melting Point
155-158ºC
Flash Point
145.4ºC
Density
1.22g/cm³
Exact Mass
184.07100
Hazard Statements
Xi: Irritant;
H-Bond Acceptor
4
H-Bond Donor
2
What is the molecular formula of 3-Ethoxy-5-fluorobenzeneboronic acid?

The molecular formula of 3-Ethoxy-5-fluorobenzeneboronic acid is C8H10BFO3.

What is the molecular weight of 3-Ethoxy-5-fluorobenzeneboronic acid?

The molecular weight of 3-Ethoxy-5-fluorobenzeneboronic acid is 183.97 g/mol.

What is the IUPAC name of 3-Ethoxy-5-fluorobenzeneboronic acid?

The IUPAC name of 3-Ethoxy-5-fluorobenzeneboronic acid is (3-ethoxy-5-fluorophenyl)boronic acid.

What is the InChI of 3-Ethoxy-5-fluorobenzeneboronic acid?

The InChI of 3-Ethoxy-5-fluorobenzeneboronic acid is InChI=1S/C8H10BFO3/c1-2-13-8-4-6(9(11)12)3-7(10)5-8/h3-5,11-12H,2H2,1H3.

What is the InChIKey of 3-Ethoxy-5-fluorobenzeneboronic acid?

The InChIKey of 3-Ethoxy-5-fluorobenzeneboronic acid is OVVBLFYHZAMJIK-UHFFFAOYSA-N.

What is the canonical SMILES of 3-Ethoxy-5-fluorobenzeneboronic acid?

The canonical SMILES of 3-Ethoxy-5-fluorobenzeneboronic acid is B(C1=CC(=CC(=C1)F)OCC)(O)O.

What is the CAS number of 3-Ethoxy-5-fluorobenzeneboronic acid?

The CAS number of 3-Ethoxy-5-fluorobenzeneboronic acid is 850589-53-6.

What is the European Community (EC) number of 3-Ethoxy-5-fluorobenzeneboronic acid?

The European Community (EC) number of 3-Ethoxy-5-fluorobenzeneboronic acid is 834-843-8.

What is the hydrogen bond donor count of 3-Ethoxy-5-fluorobenzeneboronic acid?

The hydrogen bond donor count of 3-Ethoxy-5-fluorobenzeneboronic acid is 2.

What is the hydrogen bond acceptor count of 3-Ethoxy-5-fluorobenzeneboronic acid?

The hydrogen bond acceptor count of 3-Ethoxy-5-fluorobenzeneboronic acid is 4.

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