Cas no 109364-96-7 (Ethanol, 2-(4-methoxy-2-nitrophenoxy)-)
109364-96-7 structure
Product Name:Ethanol, 2-(4-methoxy-2-nitrophenoxy)-
CAS No:109364-96-7
MF:C9H11NO5
MW:213.187342882156
CID:1188579
PubChem ID:13811101
Update Time:2025-04-20
Ethanol, 2-(4-methoxy-2-nitrophenoxy)- Chemical and Physical Properties
Names and Identifiers
-
- Ethanol, 2-(4-methoxy-2-nitrophenoxy)-
- DTXSID50550227
- 2-(4-Methoxy-2-nitrophenoxy)ethan-1-ol
- InChI=1/C9H11NO5/c1-14-7-2-3-9(15-5-4-11)8(6-7)10(12)13/h2-3,6,11H,4-5H2,1H
- AKOS008982930
- SCHEMBL12312149
- 109364-96-7
-
- Inchi： 1S/C9H11NO5/c1-14-7-2-3-9(15-5-4-11)8(6-7)10(12)13/h2-3,6,11H,4-5H2,1H3
- InChI Key： WLAVZKYXYUGWHW-UHFFFAOYSA-N
- SMILES： O(CCO)C1C=CC(=CC=1[N+](=O)[O-])OC
Computed Properties
- Exact Mass: 213.06373
- Monoisotopic Mass: 213.06372245g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 15
- Rotatable Bond Count: 4
- Complexity: 205
- 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: 1.1
- Topological Polar Surface Area: 84.5?2
Experimental Properties
- PSA: 81.83
Ethanol, 2-(4-methoxy-2-nitrophenoxy)- Related Literature
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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Piotr Szcze?niak,Sebastian Stecko RSC Adv., 2015,5, 30882-30888
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Chandran Rajendran,Govindaswamy Satishkumar,Charlotte Lang,Eric M. Gaigneaux Catal. Sci. Technol., 2020,10, 2583-2592
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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Fuming Xiao,Mengzhu Wang,Yunxiang Lei,Wenbo Dai,Yunbing Zhou,Miaochang Liu,Wenxia Gao,Xiaobo Huang,Huayue Wu J. Mater. Chem. C, 2020,8, 17410-17416
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