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4-(2-Morpholinoethoxy)phenylboronic acid, HCl - 98%, high purity , CAS No.1072945-74-4
Discover 4-(2-Morpholinoethoxy)phenylboronic acid, HCl by Aladdin Scientific in 98% for only $2,936.90. Available - in Ligands at Aladdin Scientific. Tags: .
Basic Description
Synonyms
1072945-74-4 | 4-(2-Morpholinoethoxy)phenylboronic acid, HCl | 4-(2-Morpholinoethoxy)phenylboronic acid hydrochloride | (4-(2-Morpholinoethoxy)phenyl)boronic acid hydrochloride | [4-(2-morpholin-4-ylethoxy)phenyl]boronic acid;hydrochloride | DTXSID90674496 | AMY29915
Specifications & Purity
≥98%
Storage Temp
Room temperature
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenol ethers
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Phenol ethers
Alternative Parents
Phenoxy compounds Alkyl aryl ethers Morpholines Trialkylamines Boronic acids Oxacyclic compounds Organic metalloid salts Dialkyl ethers Azacyclic compounds Organometalloid compounds Hydrochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenoxy compound - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Morpholine - Oxazinane - Boronic acid derivative - Boronic acid - Tertiary amine - Tertiary aliphatic amine - Oxacycle - Dialkyl ether - Ether - Azacycle - Organic metalloid salt - Organoheterocyclic compound - Organic oxygen compound - Amine - Organic metalloid moeity - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Hydrochloride - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenol ethers. These are aromatic compounds containing an ether group substituted with a benzene ring.
External Descriptors
Not available
Data sources
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.
Names and Identifiers
IUPAC Name
[4-(2-morpholin-4-ylethoxy)phenyl]boronic acid;hydrochloride
INCHI
InChI=1S/C12H18BNO4.ClH/c15-13(16)11-1-3-12(4-2-11)18-10-7-14-5-8-17-9-6-14;/h1-4,15-16H,5-10H2;1H
InChIKey
PZQMRZHYQZRFQT-UHFFFAOYSA-N
Smiles
B(C1=CC=C(C=C1)OCCN2CCOCC2)(O)O.Cl
Isomeric SMILES
B(C1=CC=C(C=C1)OCCN2CCOCC2)(O)O.Cl
PubChem CID
46738845
Molecular Weight
287.5
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight
287.550 g/mol
XLogP3
Hydrogen Bond Donor Count
3
Hydrogen Bond Acceptor Count
5
Rotatable Bond Count
5
Exact Mass
287.11 Da
Monoisotopic Mass
287.11 Da
Topological Polar Surface Area
62.200 Ų
Heavy Atom Count
19
Formal Charge
0
Complexity
228.000
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
2
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