CAS
1451393-04-6 Purity
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1451393-04-6 Purity
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2-Benzyloxyphenylboronic acid
CAS
190661-29-1
Catalog Number
ACM190661291
Category
Boronic Acids
Molecular Weight
228.05
Molecular Formula
C13H13BO3
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Specification
Synonyms
AKOS BRN-0079;2-BENZYLOXYBENZENEBORONIC ACID;2-BENZYLOXYPHENYLBORONIC ACID;RARECHEM AH PB 0042;O-BENZYLOXYPHENYLBORONIC ACID;2-Phenylmethoxy Phenylboronic Acid;2-BENZYLOXYPHENYLBORORNIC ACID;2-Benzyloxyphenylboronic
IUPAC Name
[2-(phenylmethoxy)phenyl]boronic acid
Canonical SMILES
B(C1=CC=CC=C1OCC2=CC=CC=C2)(O)O
InChI Key
MCAIDINWZOCYQK-UHFFFAOYSA-N
Boiling Point
428.7ºC at 760 mmHg
Melting Point
105-110ºC
Flash Point
213ºC
Density
1.2 g/cm³
Appearance
Off-white Powder
Exact Mass
228.09600
Hazard Statements
C: Corrosive;
H-Bond Acceptor
3
H-Bond Donor
2
Safety Description
S26-S36
WGK Germany
3
What is the molecular formula of 2-Benzyloxyphenylboronic acid?
The molecular formula of 2-Benzyloxyphenylboronic acid is C13H13BO3.
What is the CAS number of 2-Benzyloxyphenylboronic acid?
The CAS number of 2-Benzyloxyphenylboronic acid is 190661-29-1.
What is the IUPAC name of 2-Benzyloxyphenylboronic acid?
The IUPAC name of 2-Benzyloxyphenylboronic acid is (2-phenylmethoxyphenyl)boronic acid.
What is the molecular weight of 2-Benzyloxyphenylboronic acid?
The molecular weight of 2-Benzyloxyphenylboronic acid is 228.05 g/mol.
How many hydrogen bond donor counts does 2-Benzyloxyphenylboronic acid have?
2-Benzyloxyphenylboronic acid has 2 hydrogen bond donor counts.
How many hydrogen bond acceptor counts does 2-Benzyloxyphenylboronic acid have?
2-Benzyloxyphenylboronic acid has 3 hydrogen bond acceptor counts.
What is the topological polar surface area of 2-Benzyloxyphenylboronic acid?
The topological polar surface area of 2-Benzyloxyphenylboronic acid is 49.7Ų.
How many rotatable bond counts does 2-Benzyloxyphenylboronic acid have?
2-Benzyloxyphenylboronic acid has 4 rotatable bond counts.
Is 2-Benzyloxyphenylboronic acid a canonicalized compound?
Yes, 2-Benzyloxyphenylboronic acid is a canonicalized compound.
What is the complexity value of 2-Benzyloxyphenylboronic acid?
The complexity value of 2-Benzyloxyphenylboronic acid is 217.
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