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3,5-Di-tert-butylphenol - 98%, high purity , CAS No.1138-52-9

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3,5-Di-tert-butylphenol - 98%, high purity , CAS No.1138-52-9

1 Citations

COA

Grade & Purity:

≥98%

Cas Number: 1138-52-9
Molecular Weight: 206.32
PubChem CID: 70825
PubChem SID: 504754578

In stock

Item Number

D189774

Grouped product items
SKU	Size	Availability	Price
D189774-100mg	100mg	3	$9.90
D189774-250mg	250mg	3	$15.90
D189774-1g	1g	2	$20.90
D189774-5g	5g	1	$45.90
D189774-10g	10g	3	$81.90
D189774-25g	25g	3	$163.90
D189774-100g	100g	2	$531.90
D189774-500g	500g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$1,801.90

View related series

Fungal (844) Glucose Metabolism (1943)

Basic Description

Synonyms	EINECS 214-513-4 \| 3,5-bis(tert-butyl)phenol \| CCG-202926 \| EN300-20888 \| BAA13852 \| 3,5-BIS(1,1-DIMETHYLETHYL)PHENOL \| 3,5-Di-t-butylphenol \| AG-672/25002600 \| UNII-F4SMH8G9W7 \| Ethodin \| NSC 68209 \| AB01330491-02 \| AM82867 \| FT-0614739 \| Orcl \| PD158378
Specifications & Purity	≥98%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Phenylpropanes
Intermediate Tree Nodes	Not available
Direct Parent	Phenylpropanes
Alternative Parents	1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Organooxygen compounds Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Phenylpropane - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as phenylpropanes. These are organic compounds containing a phenylpropane moiety.
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

Associated Targets(non-human)

Xenopus laevis (337 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

Pubchem Sid	504754578
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504754578
IUPAC Name	3,5-ditert-butylphenol
INCHI	InChI=1S/C14H22O/c1-13(2,3)10-7-11(14(4,5)6)9-12(15)8-10/h7-9,15H,1-6H3
InChIKey	ZDWSNKPLZUXBPE-UHFFFAOYSA-N
Smiles	CC(C)(C)C1=CC(=CC(=C1)O)C(C)(C)C
Isomeric SMILES	CC(C)(C)C1=CC(=CC(=C1)O)C(C)(C)C
Molecular Weight	206.32
Reaxy-Rn	1910384
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1910384&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.

7 results found

Lot Number	Certificate Type	Date	Item
K1925035	Certificate of Analysis	Jun 10, 2025	D189774
G2216383	Certificate of Analysis	Apr 02, 2025	D189774
G2216388	Certificate of Analysis	Apr 02, 2025	D189774
G2216379	Certificate of Analysis	Apr 02, 2025	D189774
G2216306	Certificate of Analysis	Apr 02, 2025	D189774
I2126081	Certificate of Analysis	Jul 05, 2024	D189774
C2428015	Certificate of Analysis	Jun 04, 2022	D189774

Chemical and Physical Properties

Molecular Weight	206.320 g/mol
XLogP3	4.900
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	206.167 Da
Monoisotopic Mass	206.167 Da
Topological Polar Surface Area	20.200 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	184.000
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

Citations of This Product

How to Cite Aladdin Scientific Products?

1. Liping Zhang, Hexia Yuan, Yiyun An, Huitong Li, Yiqing Gao, Huaran Sun. (2024) Electrochemical degradation of 3,5-di-tert-butylphenol and coking reverse osmosis concentrated water by Ti/P(ANI-co-Py)/Ce,Nd-PbO2 electrodes. Journal of Environmental Chemical Engineering, 12 (113583).

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