Cas no 57351-06-1 (Propanedioic acid, (6-methoxy-2-naphthalenyl)-, diethyl ester)
57351-06-1 structure
Product Name:Propanedioic acid, (6-methoxy-2-naphthalenyl)-, diethyl ester
CAS No:57351-06-1
MF:C18H20O5
MW:316.348405838013
CID:345682
PubChem ID:15688874
Update Time:2025-04-19
Propanedioic acid, (6-methoxy-2-naphthalenyl)-, diethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Propanedioic acid, (6-methoxy-2-naphthalenyl)-, diethyl ester
- diethyl 2-(6-methoxynaphthalen-2-yl)propanedioate
- Diethyl (6-methoxynaphthalen-2-yl)propanedioate
- 57351-06-1
- diethyl 6-methoxy-2-naphthylmalonate
- SCHEMBL11460679
- DTXSID70576924
- XZVSMKUPPVZOEG-UHFFFAOYSA-N
-
- Inchi： 1S/C18H20O5/c1-4-22-17(19)16(18(20)23-5-2)14-7-6-13-11-15(21-3)9-8-12(13)10-14/h6-11,16H,4-5H2,1-3H3
- InChI Key： XZVSMKUPPVZOEG-UHFFFAOYSA-N
- SMILES： O(CC)C(C(C(=O)OCC)C1C=CC2C=C(C=CC=2C=1)OC)=O
Computed Properties
- Exact Mass: 316.1311
- Monoisotopic Mass: 316.13107373g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 23
- Rotatable Bond Count: 8
- Complexity: 390
- 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: 3.4
- Topological Polar Surface Area: 61.8?2
Experimental Properties
- PSA: 61.83
Propanedioic acid, (6-methoxy-2-naphthalenyl)-, diethyl ester Related Literature
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
57351-06-1 (Propanedioic acid, (6-methoxy-2-naphthalenyl)-, diethyl ester) Related Products
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