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Structure

4-(Trifluoromethoxy)phenylboronic acid

CAS
139301-27-2
Catalog Number
ACM139301272
Category
Boronic Acids
Molecular Weight
205.93g/mol
Molecular Formula
C7H6BF3O3

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Specification

Synonyms
AKOS BRN-0136;4-(TRIFLUOROMETHOXY)PHENYLBORONIC ACID;4-(TRIFLUOROMETHOXY)BENZENEBORONIC ACID;P-TRIFLUOROMETHOXY BENZOBORIC ACID;P-(TRIFLUOROMETHOXY)PHENYLBORONIC ACID;RARECHEM AH PB 0078;4-(Trifluoromethoxy)phenylboronicAcid(containsvaryingamountsofAnhydr
IUPAC Name
[4-(trifluoromethoxy)phenyl]boronic acid
Canonical SMILES
B(C1=CC=C(C=C1)OC(F)(F)F)(O)O
InChI
InChI=1S/C7H6BF3O3/c9-7(10,11)14-6-3-1-5(2-4-6)8(12)13/h1-4,12-13H
InChI Key
HUOFUOCSQCYFPW-UHFFFAOYSA-N
Complexity
178
Covalently-Bonded Unit Count
1
Exact Mass
206.036209g/mol
Formal Charge
0
H-Bond Acceptor
6
H-Bond Donor
2
Heavy Atom Count
14
Monoisotopic Mass
206.036209g/mol
Rotatable Bond Count
2
What is the molecular formula of 4-(Trifluoromethoxy)phenylboronic acid?

The molecular formula of 4-(Trifluoromethoxy)phenylboronic acid is C7H6BF3O3.

What is the molecular weight of 4-(Trifluoromethoxy)phenylboronic acid?

The molecular weight of 4-(Trifluoromethoxy)phenylboronic acid is 205.93 g/mol.

What are some synonyms for 4-(Trifluoromethoxy)phenylboronic acid?

Some synonyms for 4-(Trifluoromethoxy)phenylboronic acid are 4-Trifluoromethoxyphenylboronic acid and 4-(Trifluoromethoxy)benzeneboronic Acid.

What is the IUPAC name of 4-(Trifluoromethoxy)phenylboronic acid?

The IUPAC name of 4-(Trifluoromethoxy)phenylboronic acid is [4-(trifluoromethoxy)phenyl]boronic acid.

What is the InChI key of 4-(Trifluoromethoxy)phenylboronic acid?

The InChI key of 4-(Trifluoromethoxy)phenylboronic acid is HUOFUOCSQCYFPW-UHFFFAOYSA-N.

How many hydrogen bond donor counts does 4-(Trifluoromethoxy)phenylboronic acid have?

4-(Trifluoromethoxy)phenylboronic acid has 2 hydrogen bond donor counts.

What is the exact mass of 4-(Trifluoromethoxy)phenylboronic acid?

The exact mass of 4-(Trifluoromethoxy)phenylboronic acid is 206.0362087 g/mol.

How many rotatable bond counts does 4-(Trifluoromethoxy)phenylboronic acid have?

4-(Trifluoromethoxy)phenylboronic acid has 2 rotatable bond counts.

What is the topological polar surface area of 4-(Trifluoromethoxy)phenylboronic acid?

The topological polar surface area of 4-(Trifluoromethoxy)phenylboronic acid is 49.7Ų.

Is 4-(Trifluoromethoxy)phenylboronic acid a canonicalized compound?

Yes, 4-(Trifluoromethoxy)phenylboronic acid is a canonicalized compound.

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