Cas no 257621-57-1 (ETHANONE, 1-[2,6-DIHYDROXY-4-(METHOXYMETHOXY)PHENYL]-)
![ETHANONE, 1-[2,6-DIHYDROXY-4-(METHOXYMETHOXY)PHENYL]- structure](https://ossimg.kuujia.com/scimg/258000/257621-57-1x500.png)
257621-57-1 structure
Product Name:ETHANONE, 1-[2,6-DIHYDROXY-4-(METHOXYMETHOXY)PHENYL]-
CAS No:257621-57-1
MF:C10H12O5
MW:212.199283599854
CID:3434412
PubChem ID:10608579
Update Time:2025-04-21
ETHANONE, 1-[2,6-DIHYDROXY-4-(METHOXYMETHOXY)PHENYL]- Chemical and Physical Properties
Names and Identifiers
-
- ETHANONE, 1-[2,6-DIHYDROXY-4-(METHOXYMETHOXY)PHENYL]-
- SCHEMBL7893039
- F70640
- 1-(2,6-DIHYDROXY-4-(METHOXYMETHOXY)PHENYL)ETHAN-1-ONE
- 257621-57-1
- 1-(2,6-Dihydroxy-4-(methoxymethoxy)phenyl)ethanone
-
- Inchi： 1S/C10H12O5/c1-6(11)10-8(12)3-7(4-9(10)13)15-5-14-2/h3-4,12-13H,5H2,1-2H3
- InChI Key： YERNVCHGEMXKEN-UHFFFAOYSA-N
- SMILES： O(COC)C1C=C(C(C(C)=O)=C(C=1)O)O
Computed Properties
- Exact Mass: 212.06847348g/mol
- Monoisotopic Mass: 212.06847348g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 15
- Rotatable Bond Count: 4
- Complexity: 206
- 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: 1.4
- Topological Polar Surface Area: 76?2
ETHANONE, 1-[2,6-DIHYDROXY-4-(METHOXYMETHOXY)PHENYL]- Related Literature
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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