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Structure

2-Fluoro-5-methoxyphenylboronic acid

CAS
406482-19-7
Catalog Number
ACM406482197
Category
Boronic Acids
Molecular Weight
169.95g/mol
Molecular Formula
C7H8BFO3

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Specification

Synonyms
Boronic acid, (2-fluoro-5-methoxyphenyl)- (9CI);2-Fluoro-5-methoxyphenylboronic acid;3-Borono-4-fluoroanisole;Boronic acid, B-(2-fluoro-5-Methoxyphenyl)-;B-(2-fluoro-5-Methoxyphenyl)-Boronic acid;2-Fluoro-5-methoxyphenylboronic acid >=95%
IUPAC Name
(2-fluoro-5-methoxyphenyl)boronic acid
Canonical SMILES
B(C1=C(C=CC(=C1)OC)F)(O)O
InChI
InChI=1S/C7H8BFO3/c1-12-5-2-3-7(9)6(4-5)8(10)11/h2-4,10-11H,1H3
InChI Key
IPTZOWYBCLEBOE-UHFFFAOYSA-N
Complexity
145
Covalently-Bonded Unit Count
1
Exact Mass
170.055052g/mol
Formal Charge
0
H-Bond Acceptor
4
H-Bond Donor
2
Heavy Atom Count
12
Monoisotopic Mass
170.055052g/mol
Rotatable Bond Count
2
What is the molecular formula of 2-Fluoro-5-methoxyphenylboronic acid?

The molecular formula of 2-Fluoro-5-methoxyphenylboronic acid is C7H8BFO3.

What is the molecular weight of 2-Fluoro-5-methoxyphenylboronic acid?

The molecular weight of 2-Fluoro-5-methoxyphenylboronic acid is 169.95 g/mol.

What is the IUPAC name of 2-Fluoro-5-methoxyphenylboronic acid?

The IUPAC name of 2-Fluoro-5-methoxyphenylboronic acid is (2-fluoro-5-methoxyphenyl)boronic acid.

What is the InChI of 2-Fluoro-5-methoxyphenylboronic acid?

The InChI of 2-Fluoro-5-methoxyphenylboronic acid is InChI=1S/C7H8BFO3/c1-12-5-2-3-7(9)6(4-5)8(10)11/h2-4,10-11H,1H3.

What is the InChIKey of 2-Fluoro-5-methoxyphenylboronic acid?

The InChIKey of 2-Fluoro-5-methoxyphenylboronic acid is IPTZOWYBCLEBOE-UHFFFAOYSA-N.

What is the canonical SMILES of 2-Fluoro-5-methoxyphenylboronic acid?

The canonical SMILES of 2-Fluoro-5-methoxyphenylboronic acid is B(C1=C(C=CC(=C1)OC)F)(O)O.

What is the CAS number of 2-Fluoro-5-methoxyphenylboronic acid?

The CAS number of 2-Fluoro-5-methoxyphenylboronic acid is 406482-19-7.

How many hydrogen bond donor counts does 2-Fluoro-5-methoxyphenylboronic acid have?

2-Fluoro-5-methoxyphenylboronic acid has 2 hydrogen bond donor counts.

How many heavy atom counts does 2-Fluoro-5-methoxyphenylboronic acid have?

2-Fluoro-5-methoxyphenylboronic acid has 12 heavy atom counts.

Is 2-Fluoro-5-methoxyphenylboronic acid a canonicalized compound?

Yes, 2-Fluoro-5-methoxyphenylboronic acid is a canonicalized compound.

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