CAS
1451392-03-2 Purity
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1451392-03-2 Purity
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5-Formyl-2-ethoxyphenylboronic acid
CAS
1003042-92-9
Catalog Number
ACM1003042929
Category
Boronic Acids
Molecular Weight
193.99
Molecular Formula
C9H11BO4
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Specification
Synonyms
2-ETHOXY-5-FORMYLPHENYLBORONIC ACID, 1003042-92-9, ACMC-2097oa, CTK3J8745, MolPort-020-006-193, ANW-14216, AKOS006327726, AG-D-04978, C-2033
IUPAC Name
(2-ethoxy-5-formylphenyl)boronic acid
Canonical SMILES
B(C1=C(C=CC(=C1)C=O)OCC)(O)O
InChI Key
AKDKQQWBMKEDLW-UHFFFAOYSA-N
Exact Mass
194.07500
H-Bond Acceptor
4
H-Bond Donor
2
What is the molecular formula of 5-Formyl-2-ethoxyphenylboronic acid?
The molecular formula of 5-Formyl-2-ethoxyphenylboronic acid is C9H11BO4.
What is the molecular weight of 5-Formyl-2-ethoxyphenylboronic acid?
The molecular weight of 5-Formyl-2-ethoxyphenylboronic acid is 193.99 g/mol.
What is the IUPAC name of 5-Formyl-2-ethoxyphenylboronic acid?
The IUPAC name of 5-Formyl-2-ethoxyphenylboronic acid is (2-ethoxy-5-formylphenyl)boronic acid.
What is the InChI code for 5-Formyl-2-ethoxyphenylboronic acid?
The InChI code for 5-Formyl-2-ethoxyphenylboronic acid is InChI=1S/C9H11BO4/c1-2-14-9-4-3-7(6-11)5-8(9)10(12)13/h3-6,12-13H,2H2,1H3.
What is the InChIKey for 5-Formyl-2-ethoxyphenylboronic acid?
The InChIKey for 5-Formyl-2-ethoxyphenylboronic acid is AKDKQQWBMKEDLW-UHFFFAOYSA-N.
What is the canonical SMILES representation of 5-Formyl-2-ethoxyphenylboronic acid?
The canonical SMILES representation of 5-Formyl-2-ethoxyphenylboronic acid is B(C1=C(C=CC(=C1)C=O)OCC)(O)O.
What is the CAS number of 5-Formyl-2-ethoxyphenylboronic acid?
The CAS number of 5-Formyl-2-ethoxyphenylboronic acid is 1003042-92-9.
What is the hydrogen bond donor count of 5-Formyl-2-ethoxyphenylboronic acid?
The hydrogen bond donor count of 5-Formyl-2-ethoxyphenylboronic acid is 2.
What is the hydrogen bond acceptor count of 5-Formyl-2-ethoxyphenylboronic acid?
The hydrogen bond acceptor count of 5-Formyl-2-ethoxyphenylboronic acid is 4.
Is 5-Formyl-2-ethoxyphenylboronic acid a canonicalized compound?
Yes, 5-Formyl-2-ethoxyphenylboronic acid is a canonicalized compound.
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