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2-Butoxy-5-methylphenylboronic acid(Contains varying amounts of anhydride) , CAS No.480438-72-0

COA

Cas Number: 480438-72-0
Molecular Weight: 208.06
MDL number: MFCD04974068
PubChem CID: 3611527
PubChem SID: 488194473

In stock

Item Number

B170544

Grouped product items
SKU	Size	Availability	Price	Qty
B170544-1g	1g	10	$62.90
B170544-5g	5g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$263.90

Discover 2-Butoxy-5-methylphenylboronic acid(Contains varying amounts of anhydride) by Aladdin Scientific in for only $62.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	2-Butoxy-5-methylphenylboronic acid \| 480438-72-0 \| (2-butoxy-5-methylphenyl)boronic acid \| 2-Butoxy-5-methylphenylboronicacid \| SCHEMBL3318133 \| DTXSID60394174 \| MFCD04974068 \| AKOS004114045 \| AB21466 \| BS-22873 \| CS-0174036 \| FT-0698461 \| E78151
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Phenol ethers

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Phenol ethers
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Phenol ethers
Alternative Parents	Phenoxy compounds Toluenes Alkyl aryl ethers Boronic acids Organic metalloid salts Organometalloid compounds Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Phenoxy compound - Phenol ether - Toluene - Alkyl aryl ether - Monocyclic benzene moiety - Boronic acid - Boronic acid derivative - Organic metalloid salt - Ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organic metalloid moeity - Aromatic homomonocyclic 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
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	488194473
IUPAC Name	(2-butoxy-5-methylphenyl)boronic acid
INCHI	InChI=1S/C11H17BO3/c1-3-4-7-15-11-6-5-9(2)8-10(11)12(13)14/h5-6,8,13-14H,3-4,7H2,1-2H3
InChIKey	MIFKETUXFNRADI-UHFFFAOYSA-N
Smiles	B(C1=C(C=CC(=C1)C)OCCCC)(O)O
Isomeric SMILES	B(C1=C(C=CC(=C1)C)OCCCC)(O)O
WGK Germany	3
Molecular Weight	208.06
Reaxy-Rn	49574864
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=49574864&ln=

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

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Analytical Chart:

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3 results found

Lot Number	Certificate Type	Date	Item
L2314063	Certificate of Analysis	Dec 19, 2023	B170544
K1929063	Certificate of Analysis	Sep 11, 2023	B170544
L2212423	Certificate of Analysis	Dec 17, 2022	B170544

Chemical and Physical Properties

Melt Point(°C)	85-90°C
Molecular Weight	208.060 g/mol
XLogP3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Exact Mass	208.127 Da
Monoisotopic Mass	208.127 Da
Topological Polar Surface Area	49.700 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	175.000
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

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