CAS
913835-83-3 Purity
98%
913835-83-3 Purity
98%
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3-Bromo-5-(ethoxycarbonyl)phenylboronic acid
CAS
913835-88-8
Catalog Number
ACM913835888
Category
Boronic Acids
Molecular Weight
272.8883
Molecular Formula
C9H10 B Br O4
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Specification
Synonyms
913835-88-8, Ethyl 3-borono-5-bromobenzoate, 3-Bromo-5-(ethoxycarbonyl)benzeneboronic acid, (3-Bromo-5-(ethoxycarbonyl)phenyl)boronic acid, ACMC-209raa, CTK5G9460, Ethyl 3-borono-5-bromobenzoate,, MolPort-001-768-311, ANW-39632, OR3440, AKOS015833654, AG-H-74959, AK-93132, KB-51088, 3-bromo-5-(ethoxycarbonyl)phenylboronic acid, FT-0687817, B-4361, I01-10604
IUPAC Name
(3-bromo-5-ethoxycarbonylphenyl)boronic acid
Canonical SMILES
B(C1=CC(=CC(=C1)Br)C(=O)OCC)(O)O
InChI Key
KNUQTRXBSGKILE-UHFFFAOYSA-N
Boiling Point
417.8ºC at 760 mmHg
Melting Point
155-157ºC
Flash Point
206.5ºC
Density
1.58g/cm³
Exact Mass
271.98600
Hazard Statements
Xi
H-Bond Acceptor
4
H-Bond Donor
2
What is the PubChem CID for 3-Bromo-5-(ethoxycarbonyl)phenylboronic acid?
PubChem CID 44119368
What is the molecular formula of 3-Bromo-5-(ethoxycarbonyl)phenylboronic acid?
C9H10BBrO4
What is the molecular weight of 3-Bromo-5-(ethoxycarbonyl)phenylboronic acid?
272.89 g/mol
When was 3-Bromo-5-(ethoxycarbonyl)phenylboronic acid created?
It was created on July 21, 2009.
When was 3-Bromo-5-(ethoxycarbonyl)phenylboronic acid last modified?
It was last modified on December 2, 2023.
What is the IUPAC name of 3-Bromo-5-(ethoxycarbonyl)phenylboronic acid?
The IUPAC name is (3-bromo-5-ethoxycarbonylphenyl)boronic acid.
What is the InChI of 3-Bromo-5-(ethoxycarbonyl)phenylboronic acid?
The InChI is InChI=1S/C9H10BBrO4/c1-2-15-9(12)6-3-7(10(13)14)5-8(11)4-6/h3-5,13-14H,2H2,1H3.
What is the InChIKey of 3-Bromo-5-(ethoxycarbonyl)phenylboronic acid?
The InChIKey is KNUQTRXBSGKILE-UHFFFAOYSA-N.
What is the canonical SMILES of 3-Bromo-5-(ethoxycarbonyl)phenylboronic acid?
The canonical SMILES is B(C1=CC(=CC(=C1)Br)C(=O)OCC)(O)O.
What is the CAS number of 3-Bromo-5-(ethoxycarbonyl)phenylboronic acid?
The CAS number is 913835-88-8.
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