Skip to the beginning of the images gallery

4-(3-Hydroxypropylcarbamoyl)phenylboronic acid(contains varying amounts of Anhydride) - 97%, high purity , CAS No.913835-29-7

COA

Grade & Purity:

≥97%

Cas Number: 913835-29-7
Molecular Weight: 223
PubChem CID: 44119848
PubChem SID: 504770264

In stock

Item Number

H188076

Grouped product items
SKU	Size	Availability	Price
H188076-50mg	50mg	3	$11.90
H188076-250mg	250mg	3	$46.90
H188076-1g	1g	2	$123.90

Basic Description

Synonyms	913835-29-7 \| (4-((3-Hydroxypropyl)carbamoyl)phenyl)boronic acid \| 4-(3-Hydroxypropylcarbamoyl)phenylboronic acid \| [4-(3-hydroxypropylcarbamoyl)phenyl]boronic acid \| 4-(3-Hydroxypropylcarbamoyl)benzeneboronic acid \| 4-[(3-Hydroxypropyl)carbamoyl]benzeneboronic aci
Specifications & Purity	≥97%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Benzoic acids and derivatives

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Benzoic acids and derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Benzamides
Alternative Parents	Benzoyl derivatives Secondary carboxylic acid amides Boronic acids Organic metalloid salts Alkanolamines Primary alcohols Organometalloid compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Benzamide - Benzoyl - Boronic acid derivative - Boronic acid - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Alkanolamine - Organic metalloid salt - Primary alcohol - Organooxygen compound - Organonitrogen compound - Organic metalloid moeity - Alcohol - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as benzamides. These are organic compounds containing a carboxamido substituent attached to a benzene ring.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

Pubchem Sid	504770264
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504770264
IUPAC Name	[4-(3-hydroxypropylcarbamoyl)phenyl]boronic acid
INCHI	InChI=1S/C10H14BNO4/c13-7-1-6-12-10(14)8-2-4-9(5-3-8)11(15)16/h2-5,13,15-16H,1,6-7H2,(H,12,14)
InChIKey	VDMQHVJGIAQUHA-UHFFFAOYSA-N
Smiles	B(C1=CC=C(C=C1)C(=O)NCCCO)(O)O
Isomeric SMILES	B(C1=CC=C(C=C1)C(=O)NCCCO)(O)O
Molecular Weight	223
Reaxy-Rn	23191156
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=23191156&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

3 results found

Lot Number	Certificate Type	Date	Item
L2010123	Certificate of Analysis	Sep 11, 2024	H188076
L2010122	Certificate of Analysis	Sep 11, 2024	H188076
L2010121	Certificate of Analysis	Sep 11, 2024	H188076

Chemical and Physical Properties

Molecular Weight	223.040 g/mol
XLogP3
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Exact Mass	223.102 Da
Monoisotopic Mass	223.102 Da
Topological Polar Surface Area	89.800 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	217.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

Solution Calculators

Molarity Calculator

Determine the necessary mass, volume, or concentration for preparing a solution.

Mass

Concentration

Volume

M. Wt*

g/mol

*When preparing stock solutions, always use the batch-specific molecular weight of the product found on the vial label and the Certificate of Analysis (available online).

Dilution Calculator

Determine the dilution needed to prepare a stock solution.

Concentration 1 (C1)

Volume 1 (V1)

Concentration 2 (C2)

Volume 2 (V2)

Reconstitution Calculator

The reconstitution calculator enables you to quickly determine the volume of a reagent needed to reconstitute your vial. Just enter the mass of the reagent and the target concentration, and the calculator will do the rest.

Volume (to add to vial)

Mass (in vial)

Desired Reconstitution Concentration