Structure

Cyclopentylboronic acid

CAS
63076-51-7
Catalog Number
ACM63076517
Category
Boronic Acids
Molecular Weight
113.95g/mol
Molecular Formula
C5H11BO2

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Specification

IUPAC Name
cyclopentylboronic acid
Canonical SMILES
B(C1CCCC1)(O)O
InChI
InChI=1S/C5H11BO2/c7-6(8)5-3-1-2-4-5/h5,7-8H,1-4H2
InChI Key
VTTDFSNKIMAQTB-UHFFFAOYSA-N
Complexity
68.8
Covalently-Bonded Unit Count
1
Exact Mass
114.08521g/mol
Formal Charge
0
H-Bond Acceptor
2
H-Bond Donor
2
Heavy Atom Count
8
Monoisotopic Mass
114.08521g/mol
Rotatable Bond Count
1
What is the molecular formula of Cyclopentylboronic acid?

The molecular formula of Cyclopentylboronic acid is C5H11BO2.

What is the molecular weight of Cyclopentylboronic acid?

The molecular weight of Cyclopentylboronic acid is 113.95 g/mol.

What is the IUPAC name of Cyclopentylboronic acid?

The IUPAC name of Cyclopentylboronic acid is cyclopentylboronic acid.

What is the InChI of Cyclopentylboronic acid?

The InChI of Cyclopentylboronic acid is InChI=1S/C5H11BO2/c7-6(8)5-3-1-2-4-5/h5,7-8H,1-4H2.

What is the InChIKey of Cyclopentylboronic acid?

The InChIKey of Cyclopentylboronic acid is VTTDFSNKIMAQTB-UHFFFAOYSA-N.

What is the canonical SMILES of Cyclopentylboronic acid?

The canonical SMILES of Cyclopentylboronic acid is B(C1CCCC1)(O)O.

What is the CAS number of Cyclopentylboronic acid?

The CAS number of Cyclopentylboronic acid is 63076-51-7.

What is the European Community (EC) number of Cyclopentylboronic acid?

The European Community (EC) number of Cyclopentylboronic acid is 672-296-5.

What is the DSSTox Substance ID of Cyclopentylboronic acid?

The DSSTox Substance ID of Cyclopentylboronic acid is DTXSID80370218.

Is Cyclopentylboronic acid a canonicalized compound in PubChem?

Yes, Cyclopentylboronic acid is a canonicalized compound in PubChem.

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