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2-Hydroxy-4-(octyloxy)benzophenone - 99%, high purity , CAS No.1843-05-6

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2-Hydroxy-4-(octyloxy)benzophenone - 99%, high purity , CAS No.1843-05-6

8 Citations

COA

Grade & Purity:

≥99%

Cas Number: 1843-05-6
Molecular Weight: 326.43
EC Number: 217-421-2
MDL number: MFCD00027327
PubChem CID: 15797
PubChem SID: 488182178

In stock

Item Number

H109120

Grouped product items
SKU	Size	Availability	Price
H109120-25g	25g	3	$12.90
H109120-100g	100g	3	$37.90
H109120-250g	250g	3	$72.90
H109120-500g	500g	2	$112.90

View related series

Polymer / polymer reagent (675) uv absorber (3)

Basic Description

Synonyms	CHEBI:135390 \| Octabenzon \| UV-531 \| NCGC00164173-03 \| Viosorb 130 \| UF 4 \| Biosorb 130 \| 2-HYDROXY-4-(OCTYLOXY)BENZOPHENONE \| NCGC00164173-02 \| 2-Benzoyl-5-(octyloxy)phenol \| SCHEMBL27387 \| SMR000112471 \| 2-Hydroxy-4-(octyloxy)benzophenone, 98% \| OCTABEN
Specifications & Purity	≥99%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Benzophenones
Intermediate Tree Nodes	Not available
Direct Parent	Benzophenones
Alternative Parents	Diphenylmethanes Aryl-phenylketones Phenoxy compounds Phenol ethers Benzoyl derivatives Alkyl aryl ethers 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Vinylogous acids Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Benzophenone - Diphenylmethane - Aryl-phenylketone - Aryl ketone - Phenol ether - Benzoyl - Phenoxy compound - Phenol - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - 1-hydroxy-4-unsubstituted benzenoid - Vinylogous acid - Ketone - Ether - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as benzophenones. These are organic compounds containing a ketone attached to two phenyl groups.
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(Human)

PPARA Tclin Peroxisome proliferator-activated receptor alpha (9197 Activities)

Discover Target: PPARA

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	488182178
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488182178
IUPAC Name	(2-hydroxy-4-octoxyphenyl)-phenylmethanone
INCHI	InChI=1S/C21H26O3/c1-2-3-4-5-6-10-15-24-18-13-14-19(20(22)16-18)21(23)17-11-8-7-9-12-17/h7-9,11-14,16,22H,2-6,10,15H2,1H3
InChIKey	QUAMTGJKVDWJEQ-UHFFFAOYSA-N
Smiles	CCCCCCCCOC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O
Isomeric SMILES	CCCCCCCCOC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O
WGK Germany	1
RTECS	DJ1595000
Molecular Weight	326.43
Reaxy-Rn	1915198
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1915198&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.

9 results found

Lot Number	Certificate Type	Date	Item
G2319516	Certificate of Analysis	Jul 18, 2022	H109120
J2209147	Certificate of Analysis	Jul 18, 2022	H109120
J2209397	Certificate of Analysis	Jul 18, 2022	H109120
J2209148	Certificate of Analysis	Jul 18, 2022	H109120
J2209150	Certificate of Analysis	Jul 18, 2022	H109120
J2209153	Certificate of Analysis	Jul 18, 2022	H109120
K2405021	Certificate of Analysis	Jul 18, 2022	H109120
H2330035	Certificate of Analysis	Jul 18, 2022	H109120
L2426223	Certificate of Analysis	Jul 18, 2022	H109120

Chemical and Physical Properties

Solubility	Insoluble in water; Soluble in Toluene,Benzene; Slightly soluble in Ethanol
Melt Point(°C)	48°C
Molecular Weight	326.400 g/mol
XLogP3	6.800
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	10
Exact Mass	326.188 Da
Monoisotopic Mass	326.188 Da
Topological Polar Surface Area	46.500 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	349.000
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? Citations Search

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