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4-(Methylthio)benzaldehyde - 95%, high purity , CAS No.3446-89-7

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4-(Methylthio)benzaldehyde - 95%, high purity , CAS No.3446-89-7

3 Citations

COA

Grade & Purity:

≥95%

Cas Number: 3446-89-7
Molecular Weight: 152.21
Beilstein Registry Number: 8(1)533
MDL number: MFCD00006948
PubChem CID: 76985
PubChem SID: 504755129

In stock

Item Number

P133663

Grouped product items
SKU	Size	Availability	Price
P133663-5g	5g	2	$15.90
P133663-10g	10g	3	$24.90
P133663-25g	25g	3	$46.90
P133663-50g	50g	3	$83.90
P133663-100g	100g	3	$150.90
P133663-250g	250g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$221.90

View related series

aldehyde (388) Non heterocyclic block (8163)

Basic Description

Synonyms	1TVQ11BIY8 \| CAS-3446-89-7 \| Quinoline, 4-amino- \| 4-(Methylsulfanyl)benzaldehyde \| EN300-20437 \| UNII-1TVQ11BIY8 \| J-019619 \| PS-3197 \| InChI=1/C8H8OS/c1-10-8-4-2-7(6-9)3-5-8/h2-6H,1H3 \| BB 0322721 \| M0739 \| HMS3039L09 \| Acetylphenylglycin \| EINECS 222-3
Specifications & Purity	≥95%
Storage Temp	Argon charged
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Benzoyl derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Benzoyl derivatives
Alternative Parents	Thiophenol ethers Benzaldehydes Alkylarylthioethers Sulfenyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Aryl thioether - Thiophenol ether - Benzoyl - Benzaldehyde - Alkylarylthioether - Aryl-aldehyde - Sulfenyl compound - Thioether - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Aldehyde - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as benzoyl derivatives. These are organic compounds containing an acyl moiety of benzoic acid with the formula (C6H5CO-).
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)

ALDH1A1 Tchem Aldehyde dehydrogenase 1A1 (77053 Activities)

Discover Target: ALDH1A1

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

Associated Targets(non-human)

Plasmodium falciparum (966862 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	504755129
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504755129
IUPAC Name	4-methylsulfanylbenzaldehyde
INCHI	InChI=1S/C8H8OS/c1-10-8-4-2-7(6-9)3-5-8/h2-6H,1H3
InChIKey	QRVYABWJVXXOTN-UHFFFAOYSA-N
Smiles	CSC1=CC=C(C=C1)C=O
Isomeric SMILES	CSC1=CC=C(C=C1)C=O
WGK Germany	3
PubChem CID	76985
Molecular Weight	152.21
Beilstein	8(1)533
Reaxy-Rn	636158

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.

16 results found

Lot Number	Certificate Type	Date	Item
K2208518	Certificate of Analysis	Aug 23, 2024	P133663
K2208503	Certificate of Analysis	Aug 23, 2024	P133663
K2208432	Certificate of Analysis	Aug 23, 2024	P133663
K2208428	Certificate of Analysis	Aug 23, 2024	P133663
K2208459	Certificate of Analysis	Aug 23, 2024	P133663
K2208561	Certificate of Analysis	Aug 23, 2024	P133663
D2014044	Certificate of Analysis	Nov 16, 2023	P133663
K2129300	Certificate of Analysis	Sep 21, 2023	P133663
K2129109	Certificate of Analysis	Sep 21, 2023	P133663
K2129110	Certificate of Analysis	Sep 21, 2023	P133663
K2129301	Certificate of Analysis	Sep 21, 2023	P133663
K2129107	Certificate of Analysis	Sep 21, 2023	P133663
H1905088	Certificate of Analysis	Mar 17, 2023	P133663
F1519038	Certificate of Analysis	Jan 17, 2023	P133663
C2401030	Certificate of Analysis	Oct 24, 2022	P133663
G2325040	Certificate of Analysis	Oct 24, 2022	P133663

Show more⌵

Chemical and Physical Properties

Solubility	Not miscible in water.
Sensitivity	Moisture and Air sensitive.
Refractive Index	1.65
Flash Point(°F)	230 °F
Flash Point(°C)	110 °C
Boil Point(°C)	153 °C/17 mmHg
Molecular Weight	152.220 g/mol
XLogP3	2.000
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	152.03 Da
Monoisotopic Mass	152.03 Da
Topological Polar Surface Area	42.400 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	106.000
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. Zhaoxian Tang, Yanjing Gao, Shengling Jiang, Jun Nie, Fang Sun. (2022) Cinnamoylformate derivatives photoinitiators with excellent photobleaching ability and cytocompatibility for visible LED photopolymerization. PROGRESS IN ORGANIC COATINGS, 170 (106969).
2. Shichao Xu, Xiaojing Zeng, Songlin Dai, Jing Wang, Yuxiang Chen, Jie Song, Yunfei Shi, Xian Cheng, Shengliang Liao, Zhendong Zhao. (2020) Turpentine Derived Secondary Amines for Sustainable Crop Protection: Synthesis, Activity Evaluation and QSAR Study. JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY, 68 (42): (11829–11838).
3. Shan Wu, Jian Shi, Qian Duan, Ludan Shang, Xiaodong Zhang, Yuhan Duan. (2025) Thermosensitive four-arm star-shaped copolymers with phthalocyanine as core and porphyrin copolymer as arms was used as visible light photocatalyst. JOURNAL OF CATALYSIS, 445 (116009).

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