Cas no 39510-88-8 (2-Methoxymethyl-1,4-naphthoquinone)
39510-88-8 structure
Product Name:2-Methoxymethyl-1,4-naphthoquinone
CAS No:39510-88-8
MF:C12H10O3
MW:202.206003665924
CID:924648
PubChem ID:170217
Update Time:2025-04-19
2-Methoxymethyl-1,4-naphthoquinone Chemical and Physical Properties
Names and Identifiers
-
- 2-Methoxymethyl-1,4-naphthoquinone
- 1,4-naphthalenedione, 2-(methoxymethyl)-
- 2-(Methoxymethyl)-1,4-naphthoquinone
- 2-Mom-1,4-naphthoquinone
- 2-Methoxymethyl-[1,4]naphthoquinone
- 39510-88-8
- SCHEMBL3272909
- DTXSID60960136
- CHEMBL163391
- 2-(methoxymethyl)naphthalene-1,4-dione
-
- Inchi: 1S/C12H10O3/c1-15-7-8-6-11(13)9-4-2-3-5-10(9)12(8)14/h2-6H,7H2,1H3
- InChI Key: ISZFXJTUZRXWNR-UHFFFAOYSA-N
- SMILES: O(C)CC1=CC(C2C=CC=CC=2C1=O)=O
Computed Properties
- Exact Mass: 202.063
- Monoisotopic Mass: 202.062994177g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 317
- 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: 1.5
- Topological Polar Surface Area: 43.4?2
Experimental Properties
- PSA: 43.37
2-Methoxymethyl-1,4-naphthoquinone Related Literature
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Yu Long,Bing Yuan,Jianrui Niu,Xin Tong,Jiantai Ma New J. Chem., 2015,39, 1179-1185
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