Cas no 8015-01-8 (3-(3-Chlorophenyl)prop-2-yn-1-ol)
8015-01-8 structure
Product Name:3-(3-Chlorophenyl)prop-2-yn-1-ol
CAS No:8015-01-8
MF:C9H7ClO
MW:166.604281663895
CID:48037
Update Time:2023-08-02
3-(3-Chlorophenyl)prop-2-yn-1-ol Chemical and Physical Properties
Names and Identifiers
-
- Marjoram Oil
- Majorana hortensis oil
- Sweet marjoram oil
- 3-(3-chlorophenyl)prop-2-yn-1-ol
- 2-Propyn-1-ol,3-(3-chlorophenyl)-
- 3-(3-Chloro-phenyl)-prop-2-yn-1-ol
- 3-(3-chlorophenyl)-2-propyn-1-ol
- VZ25974
- BL006488
- AB0036910
- Y4129
- A839855
- 3-(3-Chlorophenyl)prop-2-yn-1-ol
-
- Inchi: 1S/C9H7ClO/c10-9-5-1-3-8(7-9)4-2-6-11/h1,3,5,7,11H,6H2
- InChI Key: JSWQDMZGLWMJEG-UHFFFAOYSA-N
- SMILES: ClC1=CC=CC(C#CCO)=C1
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 177
- XLogP3: 2.4
- Topological Polar Surface Area: 20.2
Experimental Properties
- Color/Form: Yellow or greenish yellow volatile essential oil has a warm pungent aroma of cardamom
- Density: 0.909 g/mL at 25 °C
- FEMA: 2663
- Solubility: Soluble in ethanol and most volatile oils, turbid in mineral oil, slightly soluble in propylene glycol, insoluble in glycerol
3-(3-Chlorophenyl)prop-2-yn-1-ol Security Information
- Hazard Category Code: 10-36/38-43-51/53-65
- Safety Instruction: 24-26-36/37-61-62
-
Hazardous Material Identification:
3-(3-Chlorophenyl)prop-2-yn-1-ol Related Literature
-
Yu Long,Bing Yuan,Jianrui Niu,Xin Tong,Jiantai Ma New J. Chem., 2015,39, 1179-1185
-
Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
-
Bo Chen,Xiaotong Shen,Zhangfeng Luo,Di Cai,Changjing Chen,Changwei Zhang,Peiyong Qin,Hui Cao,Tianwei Tan RSC Adv., 2018,8, 25602-25610
-
Weixuan Zeng,Ouissam El Bakouri,Henrik Ottosson Chem. Sci., 2021,12, 6159-6171
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