CAS
871329-82-7 Purity
97%
871329-82-7 Purity
97%
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3-Ethoxy-5-trifluoromethylphenylboronic acid
CAS
871332-96-6
Catalog Number
ACM871332966
Category
Boronic Acids
Molecular Weight
233.98
Molecular Formula
C9H10 B F3 O3
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Specification
Synonyms
871332-96-6, 3-ETHOXY-5-(TRIFLUOROMETHYL)PHENYLBORONIC ACID, SBB071094, AG-H-51531, 3-ETHOXY-5-(TRIFLUOROMETHYL)BENZENEBORONIC ACID, ACMC-209qhp, SureCN12260219, CTK5F7964, MolPort-001-776-311, ANW-38603, AKOS015838684, RL05416, AK-45517, KB-31585, 3-Ethoxy-5-trifluoromethylphenylboronic acid, FT-0081098, FT-0644994, V1860, 3-Ethoxy-5-trifluoromethylphenylboronic acid,, B-5695
IUPAC Name
[3-ethoxy-5-(trifluoromethyl)phenyl]boronic acid
Canonical SMILES
B(C1=CC(=CC(=C1)OCC)C(F)(F)F)(O)O
InChI Key
ATZRXKHRSOTBAM-UHFFFAOYSA-N
Boiling Point
330.9ºC at 760 mmHg
Melting Point
173-176ºC
Flash Point
153.9ºC
Density
1.31g/cm³
Exact Mass
234.06800
Hazard Statements
Xi: Irritant;
H-Bond Acceptor
6
H-Bond Donor
2
What is the molecular formula of 3-Ethoxy-5-trifluoromethylphenylboronic acid?
The molecular formula of 3-Ethoxy-5-trifluoromethylphenylboronic acid is C9H10BF3O3.
What is the molecular weight of 3-Ethoxy-5-trifluoromethylphenylboronic acid?
The molecular weight of 3-Ethoxy-5-trifluoromethylphenylboronic acid is 233.98 g/mol.
What is the IUPAC Name of 3-Ethoxy-5-trifluoromethylphenylboronic acid?
The IUPAC Name of 3-Ethoxy-5-trifluoromethylphenylboronic acid is [3-ethoxy-5-(trifluoromethyl)phenyl]boronic acid.
What is the InChI of 3-Ethoxy-5-trifluoromethylphenylboronic acid?
The InChI of 3-Ethoxy-5-trifluoromethylphenylboronic acid is "InChI=1S/C9H10BF3O3/c1-2-16-8-4-6(9(11,12)13)3-7(5-8)10(14)15/h3-5,14-15H,2H2,1H3".
What is the InChIKey of 3-Ethoxy-5-trifluoromethylphenylboronic acid?
The InChIKey of 3-Ethoxy-5-trifluoromethylphenylboronic acid is "ATZRXKHRSOTBAM-UHFFFAOYSA-N".
What is the canonical SMILES of 3-Ethoxy-5-trifluoromethylphenylboronic acid?
The canonical SMILES of 3-Ethoxy-5-trifluoromethylphenylboronic acid is "B(C1=CC(=CC(=C1)OCC)C(F)(F)F)(O)O".
What is the CAS number of 3-Ethoxy-5-trifluoromethylphenylboronic acid?
The CAS number of 3-Ethoxy-5-trifluoromethylphenylboronic acid is 871332-96-6.
What is the European Community (EC) number of 3-Ethoxy-5-trifluoromethylphenylboronic acid?
The European Community (EC) number of 3-Ethoxy-5-trifluoromethylphenylboronic acid is 801-069-7.
What is the hydrogen bond donor count of 3-Ethoxy-5-trifluoromethylphenylboronic acid?
The hydrogen bond donor count of 3-Ethoxy-5-trifluoromethylphenylboronic acid is 2.
What is the hydrogen bond acceptor count of 3-Ethoxy-5-trifluoromethylphenylboronic acid?
The hydrogen bond acceptor count of 3-Ethoxy-5-trifluoromethylphenylboronic acid is 6.
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