CAS
397843-67-3 Purity
98%
397843-67-3 Purity
98%
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2-Formyl-5-methylphenylboronic acid
CAS
40138-17-8
Catalog Number
ACM40138178
Category
Boronic Acids
Molecular Weight
163.97
Molecular Formula
C8H9O3B
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What is the molecular formula of 2-Formyl-5-methylphenylboronic acid?
The molecular formula is C8H9BO3.
What is the molecular weight of 2-Formyl-5-methylphenylboronic acid?
The molecular weight is 163.97 g/mol.
What is the IUPAC name of 2-Formyl-5-methylphenylboronic acid?
The IUPAC name is (2-formyl-5-methylphenyl)boronic acid.
What is the InChI key of 2-Formyl-5-methylphenylboronic acid?
The InChI key is MMKCZTKFYDEERR-UHFFFAOYSA-N.
What is the canonical SMILES notation of 2-Formyl-5-methylphenylboronic acid?
The canonical SMILES notation is B(C1=C(C=CC(=C1)C)C=O)(O)O.
What is the CAS number of 2-Formyl-5-methylphenylboronic acid?
The CAS number is 40138-17-8.
How many hydrogen bond donor counts are there in 2-Formyl-5-methylphenylboronic acid?
There are 2 hydrogen bond donor counts.
How many hydrogen bond acceptor counts are there in 2-Formyl-5-methylphenylboronic acid?
There are 3 hydrogen bond acceptor counts.
How many rotatable bond counts are there in 2-Formyl-5-methylphenylboronic acid?
There are 2 rotatable bond counts.
Is 2-Formyl-5-methylphenylboronic acid a canonicalized compound?
Yes, it is a canonicalized compound.
Upstream Synthesis Route 1
- 92333-30-7
- 40138-17-8
Reference: [1]Journal of Organic Chemistry,1964,vol. 29,p. 2810 - 2812
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