2-Methyl-4-(trifluoromethoxy)benzeneboronic acid

• Catalog Number: ACM850033395
• Product Name: 2-Methyl-4-(trifluoromethoxy)benzeneboronic acid
• CAS: 850033-39-5
• Category: Boronic Acids
• Synonyms: 850033-39-5, 2-methyl-4-(trifluoromethoxy)phenylboronic acid, 2-Methyl-4-(trifluoromethoxy)benzeneboronic acid, ACMC-209pza, SureCN769093, CTK5F3669, MolPort-001-776-963, ANW-37940, PC7578, SBB095862, AKOS015842385, AG-H-40693, AK-40442, KB-25347, V1841, 2-Methyl-4-trifluoromethoxyphenylboronic acid,, B-4767, [2-methyl-4-(trifluoromethoxy)phenyl]boronic acid, A841047, [2-methyl-4-(trifluoromethyloxy)phenyl]boronic acid
• IUPAC Name: [2-methyl-4-(trifluoromethoxy)phenyl]boronic acid
• Molecular Weight: 219.9535296
• Molecular Formula: C8H8O3BF3
• Canonical SMILES: B(C1=C(C=C(C=C1)OC(F)(F)F)C)(O)O
• InChI Key: VZNGQLGNHIYWOD-UHFFFAOYSA-N
• Boiling Point: 280.8ºC at 760 mmHg
• Flash Point: 123.6ºC
• Density: 1.36g/cm³
• Exact Mass: 220.05200
• Hazard Statements: Xi: Irritant
• H-Bond Acceptor: 6
• H-Bond Donor: 2

Custom Q&A

What is the PubChem CID for 2-Methyl-4-(trifluoromethoxy)benzeneboronic acid?

PubChem CID: 44717686

What is the molecular formula of 2-Methyl-4-(trifluoromethoxy)benzeneboronic acid?

Molecular Formula: C8H8BF3O3

What is the molecular weight of 2-Methyl-4-(trifluoromethoxy)benzeneboronic acid?

Molecular Weight: 219.96 g/mol

What is the IUPAC name of 2-Methyl-4-(trifluoromethoxy)benzeneboronic acid?

IUPAC Name: [2-methyl-4-(trifluoromethoxy)phenyl]boronic acid

What is the InChI of 2-Methyl-4-(trifluoromethoxy)benzeneboronic acid?

InChI: InChI=1S/C8H8BF3O3/c1-5-4-6(15-8(10,11)12)2-3-7(5)9(13)14/h2-4,13-14H,1H3

What is the InChIKey of 2-Methyl-4-(trifluoromethoxy)benzeneboronic acid?

InChIKey: VZNGQLGNHIYWOD-UHFFFAOYSA-N

What is the canonical SMILES of 2-Methyl-4-(trifluoromethoxy)benzeneboronic acid?

Canonical SMILES: B(C1=C(C=C(C=C1)OC(F)(F)F)C)(O)O

What is the CAS number of 2-Methyl-4-(trifluoromethoxy)benzeneboronic acid?

CAS: 850033-39-5

What is the European Community (EC) number of 2-Methyl-4-(trifluoromethoxy)benzeneboronic acid?

EC Number: 689-322-6

Is 2-Methyl-4-(trifluoromethoxy)benzeneboronic acid a canonicalized compound?

Yes, it is canonicalized.