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Structure

2,5-Dimethoxyphenylboronic acid

CAS
107099-99-0
Catalog Number
ACM107099990
Category
Boronic Acids
Molecular Weight
181.98
Molecular Formula
C8H11BO4

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Specification

Synonyms
Boronic acid, B-(2,5-dimethoxyphenyl)-
IUPAC Name
(2,5-dimethoxyphenyl)boronic acid
Canonical SMILES
B(C1=C(C=CC(=C1)OC)OC)(O)O
InChI
InChI=1S/C8H11BO4/c1-12-6-3-4-8(13-2)7(5-6)9(10)11/h3-5,10-11H,1-2H3
InChI Key
QOZLFNQLIKOGDR-UHFFFAOYSA-N
Boiling Point
374.5±52.0 °C
Melting Point
95-98 °C (lit.)
Density
1.19±0.1 g/ml
Complexity
153
Covalently-Bonded Unit Count
1
Exact Mass
182.075039g/mol
Formal Charge
0
H-Bond Acceptor
4
H-Bond Donor
2
Heavy Atom Count
13
Monoisotopic Mass
182.075039g/mol
Rotatable Bond Count
3
What is the PubChem CID of 2,5-Dimethoxyphenylboronic acid?

The PubChem CID of 2,5-Dimethoxyphenylboronic acid is 2734342.

What is the molecular formula of 2,5-Dimethoxyphenylboronic acid?

The molecular formula of 2,5-Dimethoxyphenylboronic acid is C8H11BO4.

What is the molecular weight of 2,5-Dimethoxyphenylboronic acid?

The molecular weight of 2,5-Dimethoxyphenylboronic acid is 181.98 g/mol.

What is the IUPAC name of 2,5-Dimethoxyphenylboronic acid?

The IUPAC name of 2,5-Dimethoxyphenylboronic acid is (2,5-dimethoxyphenyl)boronic acid.

What is the InChI of 2,5-Dimethoxyphenylboronic acid?

The InChI of 2,5-Dimethoxyphenylboronic acid is InChI=1S/C8H11BO4/c1-12-6-3-4-8(13-2)7(5-6)9(10)11/h3-5,10-11H,1-2H3.

What is the InChIKey of 2,5-Dimethoxyphenylboronic acid?

The InChIKey of 2,5-Dimethoxyphenylboronic acid is QOZLFNQLIKOGDR-UHFFFAOYSA-N.

What is the canonical SMILES of 2,5-Dimethoxyphenylboronic acid?

The canonical SMILES of 2,5-Dimethoxyphenylboronic acid is B(C1=C(C=CC(=C1)OC)OC)(O)O.

What is the CAS number of 2,5-Dimethoxyphenylboronic acid?

The CAS number of 2,5-Dimethoxyphenylboronic acid is 107099-99-0.

What is the European Community (EC) number of 2,5-Dimethoxyphenylboronic acid?

The European Community (EC) number of 2,5-Dimethoxyphenylboronic acid is 679-699-5.

Is 2,5-Dimethoxyphenylboronic acid a canonicalized compound?

Yes, 2,5-Dimethoxyphenylboronic acid is a canonicalized compound.

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