Cas no 79560-36-4 (9,10-Anthracenedione,1,3-dihydroxy-2-(methoxymethyl)-)
79560-36-4 structure
Product Name:9,10-Anthracenedione,1,3-dihydroxy-2-(methoxymethyl)-
CAS No:79560-36-4
MF:C16H12O5
MW:284.263484954834
CID:568193
PubChem ID:149782
Update Time:2024-10-27
9,10-Anthracenedione,1,3-dihydroxy-2-(methoxymethyl)- Chemical and Physical Properties
Names and Identifiers
-
- 9,10-Anthracenedione,1,3-dihydroxy-2-(methoxymethyl)-
- 1,3-dihydroxy-2-(methoxymethyl)anthracene-9,10-dione
- 1,3-DIHYDROXY-2-METHOXYMETHYLANTHRAQUINONE
- 1,3-dihydroxy-2-methoxymethyl-9,10-anthraquinone
- 2-(Methoxymethyl)-1,3-dihydroxyanthraquinone
- AC1L3ZQ7
- AC1Q4FJW
- AG-H-19144
- CCRIS 6438
- 1,3-Dihydroxy-2-methoxymethyl-anthraquinone
- Lucidin omega-methyl ether
- SCHEMBL16227056
- DTXSID30229767
- O-Me ether
- Q27107239
- Lucidin-.omega.-methyl ether
- CS-0891279
- Lucidin-
- CHEMBL485454
- CHEBI:6555
- 79560-36-4
- HY-N12071
- 1,3-Dihydroxy-2-(methoxymethyl)-9,10-anthracenedione (ACI)
- Lucidin ω-methyl ether
- DA-69390
-
- Inchi： 1S/C16H12O5/c1-21-7-11-12(17)6-10-13(16(11)20)15(19)9-5-3-2-4-8(9)14(10)18/h2-6,17,20H,7H2,1H3
- InChI Key： OBAYLECORSQIQW-UHFFFAOYSA-N
- SMILES： O=C1C2C(=C(C(COC)=C(C=2)O)O)C(=O)C2C1=CC=CC=2
Computed Properties
- Exact Mass: 284.068473
- Monoisotopic Mass: 284.068473
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 21
- Rotatable Bond Count: 2
- Complexity: 434
- 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
- Topological Polar Surface Area: 83.8
- XLogP3: 2.4
Experimental Properties
- Density: 1.456
- Boiling Point: 536.7°C at 760 mmHg
- Flash Point: 205.7°C
- Refractive Index: 1.679
9,10-Anthracenedione,1,3-dihydroxy-2-(methoxymethyl)- Related Literature
-
M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
-
Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
-
Benjamin Gabriel Poulson,Kacper Szczepski,Joanna Izabela Lachowicz,Lukasz Jaremko,Abdul-Hamid Emwas,Mariusz Jaremko RSC Adv., 2020,10, 215-227
-
R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
-
Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
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