Cas no 57754-80-0 (1,8-Dihydroxy-3-methoxy-anthrachinon)
57754-80-0 structure
Product Name:1,8-Dihydroxy-3-methoxy-anthrachinon
CAS No:57754-80-0
MF:C15H10O5
MW:270.236904621124
CID:2007442
PubChem ID:13412787
Update Time:2025-04-21
1,8-Dihydroxy-3-methoxy-anthrachinon Chemical and Physical Properties
Names and Identifiers
-
- 1,8-Dihydroxy-3-methoxy-anthrachinon
- 1,8-dihydroxy-3-methoxy-anthraquinone
- 1,8-dihydroxy-3-methoxyanthracene-9,10-dione
- 3-Me ether-1,3,8-Trihydroxyanthraquinone
- 3-methoxychrisazine
- 3-methoxychrysazin
- SCHEMBL10602832
- 3-methoxy-1,8-bis(oxidanyl)anthracene-9,10-dione
- 1,8-dihydroxy-3-methoxy-9,10-anthraquinone
- QPO
- DTXSID60540018
- 57754-80-0
- DTXCID40490805
-
- Inchi： 1S/C15H10O5/c1-20-7-5-9-13(11(17)6-7)15(19)12-8(14(9)18)3-2-4-10(12)16/h2-6,16-17H,1H3
- InChI Key： ZMPLLBBFALVVAF-UHFFFAOYSA-N
- SMILES： O(C)C1C=C(C2C(C3C(=CC=CC=3C(C=2C=1)=O)O)=O)O
Computed Properties
- Exact Mass: 270.05282342g/mol
- Monoisotopic Mass: 270.05282342g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 20
- Rotatable Bond Count: 1
- Complexity: 421
- 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: 2.7
- Topological Polar Surface Area: 83.8?2
1,8-Dihydroxy-3-methoxy-anthrachinon Related Literature
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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