基本描述

别名	苯丙烯 \| 3-苯基-1-丙烯 \| 3-苯基丙烯 \| 烯丙基苯
英文别名	3-Phenyl-1-propene \| FD14063 \| UNII-3VT7C9MEQ9 \| Benzene, 2-propenyl- \| F0001-0925 \| (prop-2-en-1-yl)benzene \| STL268883 \| 2-Propen-1-yl-benzene \| Benzene, 2-propen-1-yl- \| 3VT7C9MEQ9 \| EINECS 206-095-7 \| DTXSID00861855 \| NSC18609 \| NSC-18609 \| Allylbenze
规格或纯度	≥98%
英文名称	Allylbenzene
应用	用于有机合成
运输条件	常规运输
产品介绍	溶于乙醇、乙醚、苯，不溶于水。用于有机合成

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关联靶点（其它种属）

Staphylococcus aureus (210822 活性数据)

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

Saccharomyces cerevisiae (19171 活性数据)

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

Candida albicans (78123 活性数据)

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

Mus musculus (284745 活性数据)

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

Malassezia furfur (70 活性数据)

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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	488180966
EC号	206-095-7
分子类型	小分子
IUPAC Name	prop-2-enylbenzene
INCHI	InChI=1S/C9H10/c1-2-6-9-7-4-3-5-8-9/h2-5,7-8H,1,6H2
InChi Key	HJWLCRVIBGQPNF-UHFFFAOYSA-N
Canonical SMILES	C=CCC1=CC=CC=C1
Isomeric SMILES	C=CCC1=CC=CC=C1
WGK Germany	3
RTECS	CY2275000
PubChem CID	9309
UN Number	3295
分子量	118.18
Beilstein号	1098501
Reaxy-Rn	1098501

化学和物理性质

密度	0.89
折光率	1.511
闪点(℉)	92 °F
闪点(℃)	33℃
沸点	156-157°C
熔点	557 °C
分子量	118.180 g/mol
XLogP3	3.200
氢键供体数Hydrogen Bond Donor Count	0
氢键受体数Hydrogen Bond Acceptor Count	0
可旋转键计数Rotatable Bond Count	2
精确质量Exact Mass	118.078 Da
单同位素质量Monoisotopic Mass	118.078 Da
拓扑极表面积Topological Polar Surface Area	0.000 Å²
重原子数Heavy Atom Count	9
形式电荷Formal Charge	0
复杂度Complexity	78.000
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）

象形图	GHS08, GHS02
信号词	Danger
危险声明	H226: 易燃液体和蒸气 H304: 吞咽并进入呼吸道可能致命
预防措施声明	P280: 戴防护手套/穿防护服/戴防护眼罩/戴防护面具。 P370+P378: 火灾时：使用干砂、干粉或抗醇泡沫灭火。 P210: 远离热源，热表面，火花，明火和其他点火源。 - 禁止抽烟。 P405: 密闭存放 P501: 将内容物/容器处理到。。。 P233: 保持容器密闭。 P240: 地面/粘结容器和接收设备 P403+P235: 存放在通风良好的地方。保持低温。 P303+P361+P353: 如皮肤（或头发）沾染：立即脱掉所有沾染的衣服。用水清洗皮肤/淋浴。 P241: 使用防爆的[电气/通风/照明/.../]设备。 P331: 不要催吐 P242: 仅使用无火花的工具。 P243: 采取防静电措施 P301+P316: 如果吞咽：立即寻求紧急医疗救助。
WGK Germany	3
RTECS	CY2275000
Reaxy-Rn	1098501
个人防护装备	Eyeshields,Faceshields,full-face respirator (US),Gloves,multi-purpose combination respirator cartridge (US),type ABEK (EN14387) respirator filter

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16个结果

批号(Lot Number)	证书类型	日期	货号
F2310004	分析证书	25-04-17	A101037
F2310001	分析证书	25-03-03	A101037
F2310002	分析证书	25-03-03	A101037
B2505146	分析证书	25-02-07	A101037
J1818031	分析证书	24-04-10	A101037
D2425134	分析证书	24-03-25	A101037
D2425135	分析证书	24-03-25	A101037
D2403650	分析证书	24-03-25	A101037
F2310003	分析证书	23-05-27	A101037
E2327642	分析证书	23-05-10	A101037
B2321049	分析证书	23-02-25	A101037
B2321051	分析证书	23-02-25	A101037
B2321059	分析证书	23-02-25	A101037
D2120018	分析证书	23-01-16	A101037
K2201619	分析证书	21-12-08	A101037
L2101010	分析证书	21-12-08	A101037

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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. Dong Li, Kaixuan Wang, Jiahong Tang, Yizhou Zhao, Hanan Elhaes, Muhammad Tahir, Medhat A. Ibrahim, Yujing Li. (2023) Efficient photosensitized singlet oxygen generation in two-dimensional perovskite nanosheets via energy transfer. APPLIED SURFACE SCIENCE, 613 (155991). [10.1016/j.apsusc.2022.155991]
2. Dingxuan Ma, Yaowen Zhang, Huihui Zhao, Kang Liu, Lei Wang. (2022) Directing two copper porphyrin based polymers as highly efficient heterogeneous catalysts for styrene oxidation. APPLIED SURFACE SCIENCE, 571 (151363). [10.1016/j.apsusc.2021.151363]
3. Gaoyi Yi, Jingxia He, Baian Ji, Die Gao, Kailian Zhang, Lujun Wang, Jing Zeng, Zhining Xia, Qifeng Fu. (2020) Solvothermal-assisted in situ rapid growth of octadecylamine functionalized polydopamine-based permanent coating as stationary phase for open-tubular capillary electrochromatography. JOURNAL OF CHROMATOGRAPHY A, 1628 (461436). [PMID:32822976] [10.1016/j.chroma.2020.461436]
4. Yingpeng Huo, Jiwen Hu, Yuanyuan Tu, Zhenzhu Huang, Shudong Lin, Yangfei Hu, Chao Feng. (2020) Platinum-Imidazolyl Schiff Base Complexes Immobilized in Periodic Mesoporous Organosilica Frameworks as Catalysts for Hydrosilylation. APPLIED ORGANOMETALLIC CHEMISTRY, 34 (8): (e5697). [10.1002/aoc.5697]
5. Hui Lin, Yanhong Tang, Shuang Dong, Ruibo Lang, Hongge Chen. (2020) A new monooxygenase from Herbaspirillum huttiense catalyzed highly enantioselective epoxidation of allylbenzenes and allylic alcohols. Catalysis Science & Technology, 10 (7): (2145-2151). [10.1039/D0CY00081G]

参考文献

1. P G Debrunner,A F Dexter,C E Schulz,Y M Xia,L P Hager. (1996-11-12) Mössbauer and electron paramagnetic resonance studies of chloroperoxidase following mechanism-based inactivation with allylbenzene.. Proceedings of the National Academy of Sciences of the United States of America, 93 ((23)): (12791-12798). [PMID:8917498]
2. Mitsuo Miyazawa,Go Kohno. (2005-02-11) Suppression of chemical mutagen-induced SOS response by allylbenzen from Asiasarum heterotropoides in the Salmonella typhimurium TA1535/PSK1002 umu test.. Natural product research, 19 ((1)): (29-36). [PMID:15700642]
3. J R Idle. (2005-07-13) Christmas gingerbread (Lebkuchen) and Christmas cheer--review of the potential role of mood elevating amphetamine-like compounds formed in vivo and in furno.. Prague medical report, 106 ((1)): (27-38). [PMID:16007907]
4. Hamid Sadeghian,Seyed Mohammad Seyedi,Neda Attaran,Atena Jabbari,Zeinab Jafari. (2010-10-14) Synthesis and SAR comparative studies of 2-allyl-4-methoxy-1-alkoxybenzenes as 15-lipoxygenase inhibitors.. Journal of enzyme inhibition and medicinal chemistry, 26 ((2)): (238-244). [PMID:20939767]
5. E Martati,M G Boersma,A Spenkelink,D B Khadka,A Punt,J Vervoort,P J van Bladeren,I M C M Rietjens. (2011-03-31) Physiologically based biokinetic (PBBK) model for safrole bioactivation and detoxification in rats.. Chemical research in toxicology, 24 ((6)): (818-834). [PMID:21446753]
6. Ryosuke Matsubara,Alicia C Gutierrez,Timothy F Jamison. (2011-11-10) Nickel-catalyzed Heck-type reactions of benzyl chlorides and simple olefins.. Journal of the American Chemical Society, 133 ((47)): (19020-19023). [PMID:22066899]
7. Christopher L Rock,Ryan J Trovitch. (2018-11-30) Anti-Markovnikov terminal and gem-olefin hydrosilylation using a κ4-diimine nickel catalyst: selectivity for alkene hydrosilylation over ether C-O bond cleavage.. Dalton transactions (Cambridge, England : 2003), 48 ((2)): (461-467). [PMID:30488914]
8. Lyudmila V Parfenova,Pavel V Kovyazin,Almira Kh Bikmeeva. (2020-05-14) Bimetallic Zr,Zr-Hydride Complexes in Zirconocene Catalyzed Alkene Dimerization.. Molecules (Basel, Switzerland), 25 ((9)): [PMID:32397335]
9. Chun Yeon Choi,Kyung-Ran Park,Jung-Hee Lee,Young Jin Jeon,Kwang-Hyeon Liu,Sangtaek Oh,Dong-Eun Kim,Sung Su Yea. (2007-08-19) Isoeugenol suppression of inducible nitric oxide synthase expression is mediated by down-regulation of NF-kappaB, ERK1/2, and p38 kinase.. European journal of pharmacology, 576 ((1-3)): (151-159). [PMID:17698059]
10. Thi X Thi Luu,Trinh To Lam,Thach Ngoc Le,Fritz Duus. (2009-09-29) Fast and green microwave-assisted conversion of essential oil allylbenzenes into the corresponding aldehydes via alkene isomerization and subsequent potassium permanganate promoted oxidative alkene group cleavage.. Molecules (Basel, Switzerland), 14 ((9)): (3411-3424). [PMID:19783934]
11. Eric A Standley,Timothy F Jamison. (2013-01-16) Simplifying nickel(0) catalysis: an air-stable nickel precatalyst for the internally selective benzylation of terminal alkenes.. Journal of the American Chemical Society, 135 ((4)): (1585-1592). [PMID:23316879]
12. P T K Lee,L Rosenberg. (2017-04-01) Borane-catalysed postpolymerisation modification of the Si-H bonds in poly(phenylsilane).. Dalton transactions (Cambridge, England : 2003), 46 ((27)): (8818-8826). [PMID:28361144]
13. Dong Li, Kaixuan Wang, Jiahong Tang, Yizhou Zhao, Hanan Elhaes, Muhammad Tahir, Medhat A. Ibrahim, Yujing Li. (2023) Efficient photosensitized singlet oxygen generation in two-dimensional perovskite nanosheets via energy transfer. APPLIED SURFACE SCIENCE, 613 (155991). [10.1016/j.apsusc.2022.155991]
14. Dingxuan Ma, Yaowen Zhang, Huihui Zhao, Kang Liu, Lei Wang. (2022) Directing two copper porphyrin based polymers as highly efficient heterogeneous catalysts for styrene oxidation. APPLIED SURFACE SCIENCE, 571 (151363). [10.1016/j.apsusc.2021.151363]
15. Gaoyi Yi, Jingxia He, Baian Ji, Die Gao, Kailian Zhang, Lujun Wang, Jing Zeng, Zhining Xia, Qifeng Fu. (2020) Solvothermal-assisted in situ rapid growth of octadecylamine functionalized polydopamine-based permanent coating as stationary phase for open-tubular capillary electrochromatography. JOURNAL OF CHROMATOGRAPHY A, 1628 (461436). [PMID:32822976] [10.1016/j.chroma.2020.461436]
16. Yingpeng Huo, Jiwen Hu, Yuanyuan Tu, Zhenzhu Huang, Shudong Lin, Yangfei Hu, Chao Feng. (2020) Platinum-Imidazolyl Schiff Base Complexes Immobilized in Periodic Mesoporous Organosilica Frameworks as Catalysts for Hydrosilylation. APPLIED ORGANOMETALLIC CHEMISTRY, 34 (8): (e5697). [10.1002/aoc.5697]
17. Hui Lin, Yanhong Tang, Shuang Dong, Ruibo Lang, Hongge Chen. (2020) A new monooxygenase from Herbaspirillum huttiense catalyzed highly enantioselective epoxidation of allylbenzenes and allylic alcohols. Catalysis Science & Technology, 10 (7): (2145-2151). [10.1039/D0CY00081G]

溶液计算器

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货号 (SKU)	包装规格	是否现货
A101037-5ml	5ml	现货
A101037-25ml	25ml	现货
A101037-100ml	100ml	现货
A101037-500ml	500ml	现货

烯丙苯

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基本描述

AI解读

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）

质检证书（CoA,COO,BSE/TSE 和分析图谱)

显示更多⌵

相关文档

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