Basic Description

Synonyms	3-Indoleacrylic acid \| trans-3-Indoleacrylic acid \| 1204-06-4 \| 29953-71-7 \| INDOLE-3-ACRYLIC ACID \| 3-(1H-Indol-3-yl)acrylic acid \| 3-Indolylacrylic acid \| Indoleacrylic acid \| (E)-3-(1H-indol-3-yl)prop-2-enoic acid \| Indole-3beta-acrylic acid \| trans-Indole-3-acrylic acid \|
Specifications & Purity	≥98%
Storage Temp	Store at 2-8°C
Shipped In	Wet ice
Product Description	Application It is an important raw material and intermediate used in organic synthesis, pharmaceuticals, agrochemicals.

Associated Targets(Human)

ACHE Tclin Acetylcholinesterase (18204 Activities)

Discover Target: ACHE

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

KYAT1 Tbio Kynurenine--oxoglutarate transaminase I (96 Activities)

Discover Target: KYAT1

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

Associated Targets(non-human)

Tdo2 Tryptophan 2,3-dioxygenase (8 Activities)

Discover Target: Tdo2

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

BCHE Cholinesterase (8742 Activities)

Discover Target: BCHE

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

Names and Identifiers

Pubchem Sid	488195509
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488195509
IUPAC Name	(E)-3-(1H-indol-3-yl)prop-2-enoic acid
INCHI	InChI=1S/C11H9NO2/c13-11(14)6-5-8-7-12-10-4-2-1-3-9(8)10/h1-7,12H,(H,13,14)/b6-5+
InChi Key	PLVPPLCLBIEYEA-AATRIKPKSA-N
Canonical SMILES	C1=CC=C2C(=C1)C(=CN2)C=CC(=O)O
Isomeric SMILES	C1=CC=C2C(=C1)C(=CN2)/C=C/C(=O)O
WGK Germany	3
RTECS	NL3680000
PubChem CID	5375048
Molecular Weight	187.19
Beilstein	6317

Certificates

Certificate of Analysis(COA)

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To view the certificate results,please click on a Lot number.For Lot numbers from past orders,please use our order status section

11 results found

Lot Number	Certificate Type	Date	Item
H2120420	Certificate of Analysis	May 12, 2023	T122382
H2120421	Certificate of Analysis	May 12, 2023	T122382
H2120424	Certificate of Analysis	May 12, 2023	T122382
C2316432	Certificate of Analysis	Jan 02, 2023	T122382
C2316433	Certificate of Analysis	Jan 02, 2023	T122382
C2316435	Certificate of Analysis	Jan 02, 2023	T122382
C2316436	Certificate of Analysis	Jan 02, 2023	T122382
C2316437	Certificate of Analysis	Jan 02, 2023	T122382
C2316441	Certificate of Analysis	Jan 02, 2023	T122382
C2316443	Certificate of Analysis	Jan 02, 2023	T122382
F2406072	Certificate of Analysis	Jan 02, 2023	T122382

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Chemical and Physical Properties

Solubility	Soluble in water.
Boil Point(°C)	432.8°C at 760 mmHg
Melt Point(°C)	185°C

Safety and Hazards(GHS)

Pictogram(s)	GHS07
Signal	Warning
Hazard Statements	H315:Causes skin irritation H319:Causes serious eye irritation H335:May cause respiratory irritation
Precautionary Statements	P261:Avoid breathing dust/fume/gas/mist/vapors/spray. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present and easy to do - continue rinsing. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of water. P321:Specific treatment (see ... on this label). P405:Store locked up. P501:Dispose of contents/container to ... P264:Wash hands [and …] thoroughly after handling. P271:Use only outdoors or in a well-ventilated area. P304+P340:IF INHALED: Remove person to fresh air and keep comfortable for breathing. P403+P233:Store in a well-ventilated place. Keep container tightly closed. P362+P364:Take off contaminated clothing and wash it before reuse. P264+P265:Wash hands [and …] thoroughly after handling. Do not touch eyes. P337+P317:If eye irritation persists: Get medical help. P332+P317:If skin irritation occurs: Get medical help. P319:Get medical help if you feel unwell.
WGK Germany	3
RTECS	NL3680000

Citations of This Product

1. Zheng-Meng Jiang, Su-Ling Zeng, Tian-Qing Huang, Yang Lin, Fang-Fang Wang, Xing-Jiao Gao, Jing Li, Ping Li, E-Hu Liu. (2023) Sinomenine ameliorates rheumatoid arthritis by modulating tryptophan metabolism and activating aryl hydrocarbon receptor via gut microbiota regulation. Science Bulletin, [PMID:37422372]
2. Qixing Nie, Yonggan Sun, Mingzhi Li, Sheng Zuo, Chunhua Chen, Qiongni Lin, Shaoping Nie. (2023) Targeted modification of gut microbiota and related metabolites via dietary fiber. CARBOHYDRATE POLYMERS, 316 (120986). [PMID:37321707]
3. Shuyuan Cao, Shengjie Hu, Ping Jiang, Zhan Zhang, Lei Li, Qian Wu. (2023) Effects of sulforaphane on breast cancer based on metabolome and microbiome. Food Science & Nutrition, 11 (5): (2277-2287). [PMID:37181316]
4. Wu Hao, Bao Yuling, Yan Tongtong, Huang Hui, Jiang Ping, Zhang Zhan, Li Lei, Wu Qian. (2023) PAH-induced metabolic changes related to inflammation in childhood asthma. ENVIRONMENTAL SCIENCE AND POLLUTION RESEARCH, 30 (5): (13739-13754). [PMID:36136199]

References

1. Zheng-Meng Jiang, Su-Ling Zeng, Tian-Qing Huang, Yang Lin, Fang-Fang Wang, Xing-Jiao Gao, Jing Li, Ping Li, E-Hu Liu. (2023) Sinomenine ameliorates rheumatoid arthritis by modulating tryptophan metabolism and activating aryl hydrocarbon receptor via gut microbiota regulation. Science Bulletin, [PMID:37422372]
2. Qixing Nie, Yonggan Sun, Mingzhi Li, Sheng Zuo, Chunhua Chen, Qiongni Lin, Shaoping Nie. (2023) Targeted modification of gut microbiota and related metabolites via dietary fiber. CARBOHYDRATE POLYMERS, 316 (120986). [PMID:37321707]
3. Shuyuan Cao, Shengjie Hu, Ping Jiang, Zhan Zhang, Lei Li, Qian Wu. (2023) Effects of sulforaphane on breast cancer based on metabolome and microbiome. Food Science & Nutrition, 11 (5): (2277-2287). [PMID:37181316]
4. Wu Hao, Bao Yuling, Yan Tongtong, Huang Hui, Jiang Ping, Zhang Zhan, Li Lei, Wu Qian. (2023) PAH-induced metabolic changes related to inflammation in childhood asthma. ENVIRONMENTAL SCIENCE AND POLLUTION RESEARCH, 30 (5): (13739-13754). [PMID:36136199]

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SKU	Size	Availability	Price
T122382-250mg	250mg	In stock	$12.90
T122382-1g	1g	In stock	$37.90
T122382-5g	5g	In stock	$98.90
T122382-25g	25g	In stock	$377.90

trans-3-Indoleacrylic acid - 98%, high purity , CAS No.29953-71-7