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Structure

2-Formylthiophene-3-boronic acid

CAS
4347-31-3
Catalog Number
ACM4347313
Category
Boronic Acids
Molecular Weight
155.97g/mol
Molecular Formula
C5H5BO3S

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Specification

IUPAC Name
(2-formylthiophen-3-yl)boronic acid
Canonical SMILES
B(C1=C(SC=C1)C=O)(O)O
InChI
InChI=1S/C5H5BO3S/c7-3-5-4(6(8)9)1-2-10-5/h1-3,8-9H
InChI Key
BBENFHSYKBYWJX-UHFFFAOYSA-N
Complexity
130
Covalently-Bonded Unit Count
1
Exact Mass
156.005245g/mol
Formal Charge
0
H-Bond Acceptor
4
H-Bond Donor
2
Heavy Atom Count
10
Monoisotopic Mass
156.005245g/mol
Rotatable Bond Count
2
What is the molecular formula of 2-Formylthiophene-3-boronic acid?

The molecular formula is C5H5BO3S.

What are the synonyms for 2-Formylthiophene-3-boronic acid?

The synonyms are: 2-Formylthiophene-3-boronic acid, 4347-31-3, (2-formylthiophen-3-yl)boronic Acid, 2-Formyl-3-thiopheneboronic acid, 2-formylthiophen-3-ylboronic acid.

What is the molecular weight of 2-Formylthiophene-3-boronic acid?

The molecular weight is 155.97 g/mol.

What is the IUPAC name of 2-Formylthiophene-3-boronic acid?

The IUPAC name is (2-formylthiophen-3-yl)boronic acid.

What is the InChI of 2-Formylthiophene-3-boronic acid?

The InChI is InChI=1S/C5H5BO3S/c7-3-5-4(6(8)9)1-2-10-5/h1-3,8-9H.

What is the InChIKey of 2-Formylthiophene-3-boronic acid?

The InChIKey is BBENFHSYKBYWJX-UHFFFAOYSA-N.

What is the canonical SMILES of 2-Formylthiophene-3-boronic acid?

The canonical SMILES is B(C1=C(SC=C1)C=O)(O)O.

What is the CAS number of 2-Formylthiophene-3-boronic acid?

The CAS number is 4347-31-3.

What is the hydrogen bond donor count of 2-Formylthiophene-3-boronic acid?

The hydrogen bond donor count is 2.

Is 2-Formylthiophene-3-boronic acid a canonicalized compound?

Yes, it is a canonicalized compound.

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