Cas no 76246-81-6 (Ethanone, 1-[3,5-dimethoxy-4-(phenylmethoxy)phenyl]-)
![Ethanone, 1-[3,5-dimethoxy-4-(phenylmethoxy)phenyl]- structure](https://ossimg.kuujia.com/scimg/76500/76246-81-6x500.png)
76246-81-6 structure
Product Name:Ethanone, 1-[3,5-dimethoxy-4-(phenylmethoxy)phenyl]-
CAS No:76246-81-6
MF:C17H18O4
MW:286.322425365448
CID:538123
PubChem ID:5169036
Update Time:2025-04-19
Ethanone, 1-[3,5-dimethoxy-4-(phenylmethoxy)phenyl]- Chemical and Physical Properties
Names and Identifiers
-
- Ethanone, 1-[3,5-dimethoxy-4-(phenylmethoxy)phenyl]-
- 1-(3,5-dimethoxy-4-phenylmethoxyphenyl)ethanone
- 76246-81-6
- 1-[4-(benzyloxy)-3,5-dimethoxyphenyl]ethan-1-one
- AKOS023704151
- DTXSID70409102
- 4-(BENZYLOXY)-3,5-DIMETHOXYACETOPHENONE
- 4'-benzyloxy-3',5'-dimethoxyacetophenone
-
- Inchi： 1S/C17H18O4/c1-12(18)14-9-15(19-2)17(16(10-14)20-3)21-11-13-7-5-4-6-8-13/h4-10H,11H2,1-3H3
- InChI Key： VVNNLIIHXUFTIW-UHFFFAOYSA-N
- SMILES： O(CC1C=CC=CC=1)C1C(=CC(C(C)=O)=CC=1OC)OC
Computed Properties
- Exact Mass: 286.12054
- Monoisotopic Mass: 286.12050905g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 21
- Rotatable Bond Count: 6
- Complexity: 311
- 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
- Topological Polar Surface Area: 44.8?2
Experimental Properties
- PSA: 44.76
Ethanone, 1-[3,5-dimethoxy-4-(phenylmethoxy)phenyl]- Related Literature
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1. Exclusive enantioselective recognition of glucopyranosides by inherently chiral hemicryptophanes?Olivier Perraud,Alexandre Martinez,Jean-Pierre Dutasta Chem. Commun., 2011,47, 5861-5863
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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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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