Cas no 54022-77-4 (Acetyl chloride,2-(4-butoxyphenoxy)-)
54022-77-4 structure
Product Name:Acetyl chloride,2-(4-butoxyphenoxy)-
CAS No:54022-77-4
MF:C12H15ClO3
MW:242.698703050613
CID:378045
PubChem ID:104674
Update Time:2025-04-19
Acetyl chloride,2-(4-butoxyphenoxy)- Chemical and Physical Properties
Names and Identifiers
-
- Acetyl chloride,2-(4-butoxyphenoxy)-
- (4-Butoxyphenoxy)acetyl chloride
- 2-(4-butoxyphenoxy)acetyl chloride
- DTXSID00202365
- 54022-77-4
- NS00032919
- EINECS 258-926-8
-
- Inchi： 1S/C12H15ClO3/c1-2-3-8-15-10-4-6-11(7-5-10)16-9-12(13)14/h4-7H,2-3,8-9H2,1H3
- InChI Key： VUHUVRUYCQVHDT-UHFFFAOYSA-N
- SMILES： ClC(COC1C=CC(=CC=1)OCCCC)=O
Computed Properties
- Exact Mass: 242.07105
- Monoisotopic Mass: 242.071
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 7
- Complexity: 200
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.8
- Topological Polar Surface Area: 35.5?2
Experimental Properties
- Density: 1.144
- Boiling Point: 326.2°Cat760mmHg
- Flash Point: 127.4°C
- Refractive Index: 1.506
- PSA: 35.53
Acetyl chloride,2-(4-butoxyphenoxy)- Related Literature
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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