基本描述

别名	氢化肉桂酸 \| 3-苯基丙酸 \| 苄基乙酸
英文别名	3-phenylproionic acid \| 3-phenylpropanoic acid;3-Phenylpropionic Acid \| InChI=1/C9H10O2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,10,11 \| SCHEMBL3419 \| SY001654 \| 3-Phenylpropionsaeure \| 3-Phenylpropionic acid;3-Phenylpropanoic acid;3-Phenyl-n-propionic a
规格或纯度	化学纯（CP）, ≥98%
英文名称	3-Phenylpropionic acid
应用	Hydrocinnamic acid was used in the synthesis of three medium-chain acyl-Coenzyme A′s i.e. 3-phenylpropionyl-CoA from mixed anhydrides of fatty acids.
运输条件	常规运输
产品介绍	水中溶解度:0.5% ，更溶于热水，溶于冰醋酸、醇、苯、醚、氯仿、石油醚和二硫化碳。 Hydrocinnamic acid was used in the synthesis of three medium-chain acyl-Coenzyme A′s i.e. 3-phenylpropionyl-CoA from mixed anhydrides of fatty acids. Product Description 3-Phenylpropionic acid has been identified as a volatile constituent of grapes and Nam-pla fermented fish sauce. Hydrocinnamic acid forms complexes with uranium(VI) and has been investigated in aqueous solution by attenuated total reflection fourier transform infrared spectroscopy. Hydrocinnamic acids are the major rhizospheric compounds with known growth regulatory activity. Product Application Hydrocinnamic acid was used in the synthesis of three medium-chain acyl-Coenzyme A′s i.e. 3-phenylpropionyl-CoA from mixed anhydrides of fatty acids.

关联靶点（人）

TYR Tclin Tyrosinase (717 活性数据)

点击查看靶蛋白信息： TYR

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

APP Tclin Amyloid-beta A4 protein (8510 活性数据)

点击查看靶蛋白信息： APP

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

KEAP1 Tclin Kelch-like ECH-associated protein 1 (1736 活性数据)

点击查看靶蛋白信息： KEAP1

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

CTBP2 Tchem C-terminal-binding protein 2 (36 活性数据)

点击查看靶蛋白信息： CTBP2

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

关联靶点（其它种属）

B16 (5829 活性数据)

点击查看此靶标相关信息

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

clpP ATP-dependent Clp protease proteolytic subunit (245 活性数据)

点击查看靶蛋白信息： clpP

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

作用机制

作用机制	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	参考文献

名称和识别符

PubChem SID	504750350
EC号	207-924-5
分子类型	小分子
IUPAC Name	3-phenylpropanoic acid
INCHI	InChI=1S/C9H10O2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,10,11)
InChi Key	XMIIGOLPHOKFCH-UHFFFAOYSA-N
Canonical SMILES	C1=CC=C(C=C1)CCC(=O)O
Isomeric SMILES	C1=CC=C(C=C1)CCC(=O)O
WGK Germany	3
RTECS	DA8600000
PubChem CID	107
分子量	150.17
Beilstein号	907515
Reaxy-Rn	907515

化学和物理性质

溶解性	Soluble in ethanol (50 mg/ml), water (partly ), chloroform, alcohol, and benzene.
密度	1.071
闪点(℉)	230°F
闪点(℃)	113°C
沸点	280°C
熔点	45-48°C
分子量	150.170 g/mol
XLogP3	1.800
氢键供体数Hydrogen Bond Donor Count	1
氢键受体数Hydrogen Bond Acceptor Count	2
可旋转键计数Rotatable Bond Count	3
精确质量Exact Mass	150.068 Da
单同位素质量Monoisotopic Mass	150.068 Da
拓扑极表面积Topological Polar Surface Area	37.300 Å²
重原子数Heavy Atom Count	11
形式电荷Formal Charge	0
复杂度Complexity	126.000
同位素原子数Isotope Atom Count	0
定义的原子立体中心计数Defined Atom Stereocenter Count	0
未定义的原子立体中心计数Undefined Atom Stereocenter Count	0
定义的键立体中心计数Defined Bond Stereocenter Count	0
未定义的键立体中心计数Undefined Bond Stereocenter Count	0
所有立体化学键的总数The total count of all stereochemical bonds	0
共价键合单元计数Covalently-Bonded Unit Count	1

安全和危险性（GHS）

WGK Germany	3
RTECS	DA8600000
Reaxy-Rn	907515
Merck Index	4784
个人防护装备	Eyeshields,Gloves,type N95 (US),type P1 (EN143) respirator filter

SDS英文版

技术规格说明书

Ignition Residue (as sulfate)	0-0.1（%）
Melting point	47-51（℃）
Purity(HPLC)	98-100（%）
Solubility in EtOH，clear,50mg/ml	pass

技术规格说明书

质检证书（CoA,COO,BSE/TSE 和分析图谱)

C of A & Other Certificates(BSE/TSE, COO):

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找到14个结果

批号(Lot Number)	证书类型	日期	货号
L2008043	分析证书	24-09-14	P109277
L2008042	分析证书	24-09-14	P109277
G2422144	分析证书	24-08-05	P109277
G2422145	分析证书	24-08-05	P109277
G2422143	分析证书	24-08-05	P109277
A2304194	分析证书	23-01-14	P109277
J2210654	分析证书	22-10-17	P109277
J2210658	分析证书	22-10-17	P109277
J2210659	分析证书	22-10-17	P109277
J2120005	分析证书	21-10-22	P109277
C2205367	分析证书	21-10-22	P109277
C2205368	分析证书	21-10-22	P109277
C2205374	分析证书	21-10-22	P109277
C2205381	分析证书	21-10-22	P109277

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此产品的引用文献

如何在您的发表作品中引用阿拉丁的产品和网站?

1. Zhipeng Huang, Yang Yang, Junju Mu, Genheng Li, Jianyu Han, Puning Ren, Jian Zhang, Nengchao Luo, Ke-Li Han, Feng Wang. (2023) Controlling the reactions of free radicals with metal-radical interaction. CHINESE JOURNAL OF CATALYSIS, 45 (120). [10.1016/S1872-2067(22)64181-0]
2. Yang Li, Ying Peng, Ping Ma, Mengyue Wang, Chongsheng Peng, Pengfei Tu, Xiaobo Li. (2019) In vitro and in vivo metabolism of Cistanche tubulosa extract in normal and chronic unpredictable stress-induced depressive rats. JOURNAL OF CHROMATOGRAPHY B-ANALYTICAL TECHNOLOGIES IN THE BIOMEDICAL AND LIFE SCIENCES, 1125 (121728). [PMID:31352203] [10.1016/j.jchromb.2019.121728]
3. Zhao Kai-jing, Chen Yang, Hong Shi-jin, Yang Yi-ting, Xu Jiong, Yang Han-yu, Zhu Liang, Liu Ming, Xie Qiu-shi, Tang Xian-ge, Yang Ting-ting, Zhou Ya-qian, Liu Li, Liu Xiao-dong. (2019) Characteristics of β-oxidative and reductive metabolism on the acyl side chain of cinnamic acid and its analogues in rats. ACTA PHARMACOLOGICA SINICA, 40 (8): (1106-1118). [PMID:30792487] [10.1038/s41401-019-0218-8]
4. Yang Li, Guisheng Zhou, Ying Peng, Pengfei Tu, Xiaobo Li. (2016) Screening and identification of three typical phenylethanoid glycosides metabolites from Cistanches Herba by human intestinal bacteria using UPLC/Q-TOF-MS. JOURNAL OF PHARMACEUTICAL AND BIOMEDICAL ANALYSIS, 118 (167). [PMID:26551535] [10.1016/j.jpba.2015.10.038]
5. Yang Li,Ying Peng,Mengyue Wang,Guisheng Zhou,Yulong Zhang,Xiaobo Li. (2016-09-19) Rapid screening and identification of the differences between metabolites of Cistanche deserticola and C. tubulosa water extract in rats by UPLC-Q-TOF-MS combined pattern recognition analysis.. Journal of pharmaceutical and biomedical analysis, 131 (364-372). [PMID:27639339]
6. Yang Li,Ying Peng,Mengyue Wang,Pengfei Tu,Xiaobo Li. (2017-08-05) Human Gastrointestinal Metabolism of the Cistanches Herba Water Extract in Vitro: Elucidation of the Metabolic Profile Based on Comprehensive Metabolite Identification in Gastric Juice, Intestinal Juice, Human Intestinal Bacteria, and Intestinal Microsomes.. Journal of agricultural and food chemistry, 65 ((34)): (7447-7456). [PMID:28771352]

参考文献

1. Zhipeng Huang, Yang Yang, Junju Mu, Genheng Li, Jianyu Han, Puning Ren, Jian Zhang, Nengchao Luo, Ke-Li Han, Feng Wang. (2023) Controlling the reactions of free radicals with metal-radical interaction. CHINESE JOURNAL OF CATALYSIS, 45 (120). [10.1016/S1872-2067(22)64181-0]
2. Yang Li, Ying Peng, Ping Ma, Mengyue Wang, Chongsheng Peng, Pengfei Tu, Xiaobo Li. (2019) In vitro and in vivo metabolism of Cistanche tubulosa extract in normal and chronic unpredictable stress-induced depressive rats. JOURNAL OF CHROMATOGRAPHY B-ANALYTICAL TECHNOLOGIES IN THE BIOMEDICAL AND LIFE SCIENCES, 1125 (121728). [PMID:31352203] [10.1016/j.jchromb.2019.121728]
3. Zhao Kai-jing, Chen Yang, Hong Shi-jin, Yang Yi-ting, Xu Jiong, Yang Han-yu, Zhu Liang, Liu Ming, Xie Qiu-shi, Tang Xian-ge, Yang Ting-ting, Zhou Ya-qian, Liu Li, Liu Xiao-dong. (2019) Characteristics of β-oxidative and reductive metabolism on the acyl side chain of cinnamic acid and its analogues in rats. ACTA PHARMACOLOGICA SINICA, 40 (8): (1106-1118). [PMID:30792487] [10.1038/s41401-019-0218-8]
4. Yang Li, Guisheng Zhou, Ying Peng, Pengfei Tu, Xiaobo Li. (2016) Screening and identification of three typical phenylethanoid glycosides metabolites from Cistanches Herba by human intestinal bacteria using UPLC/Q-TOF-MS. JOURNAL OF PHARMACEUTICAL AND BIOMEDICAL ANALYSIS, 118 (167). [PMID:26551535] [10.1016/j.jpba.2015.10.038]
5. Yang Li,Ying Peng,Mengyue Wang,Guisheng Zhou,Yulong Zhang,Xiaobo Li. (2016-09-19) Rapid screening and identification of the differences between metabolites of Cistanche deserticola and C. tubulosa water extract in rats by UPLC-Q-TOF-MS combined pattern recognition analysis.. Journal of pharmaceutical and biomedical analysis, 131 (364-372). [PMID:27639339]
6. Yang Li,Ying Peng,Mengyue Wang,Pengfei Tu,Xiaobo Li. (2017-08-05) Human Gastrointestinal Metabolism of the Cistanches Herba Water Extract in Vitro: Elucidation of the Metabolic Profile Based on Comprehensive Metabolite Identification in Gastric Juice, Intestinal Juice, Human Intestinal Bacteria, and Intestinal Microsomes.. Journal of agricultural and food chemistry, 65 ((34)): (7447-7456). [PMID:28771352]

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货号 (SKU)	包装规格	是否现货
P109277-25g	25g	现货
P109277-100g	100g	现货
P109277-250g	250g	现货
P109277-500g	500g	现货

3-苯丙酸

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基本描述

关联靶点（人）

关联靶点（其它种属）

作用机制

名称和识别符

化学和物理性质

安全和危险性（GHS）

技术规格说明书

质检证书（CoA,COO,BSE/TSE 和分析图谱)

显示更多⌵

此产品的引用文献

参考文献

溶液计算器

摩尔浓度计算器

稀释计算器

复溶计算器