Cas no 64543-61-9 (Phenanthro[4,3-d]-1,3-dioxole-5-carboxylicacid, 10-hydroxy-8-methoxy-)
![Phenanthro[4,3-d]-1,3-dioxole-5-carboxylicacid, 10-hydroxy-8-methoxy- structure](https://ossimg.kuujia.com/scimg/65000/64543-61-9x500.png)
64543-61-9 structure
Product Name:Phenanthro[4,3-d]-1,3-dioxole-5-carboxylicacid, 10-hydroxy-8-methoxy-
CAS No:64543-61-9
MF:C17H12O6
MW:312.273585319519
CID:508598
PubChem ID:71401264
Update Time:2025-04-19
Phenanthro[4,3-d]-1,3-dioxole-5-carboxylicacid, 10-hydroxy-8-methoxy- Chemical and Physical Properties
Names and Identifiers
-
- Phenanthro[4,3-d]-1,3-dioxole-5-carboxylicacid, 10-hydroxy-8-methoxy-
- 10-hydroxy-8-methoxynaphtho[2,1-g][1,3]benzodioxole-5-carboxylic acid
- Aristofolin D
- O10-Demethylaristolinic acid
- Phenanthro[3,4-d]-1,3-dioxole-5-carboxylicacid, 10-hydroxy-8-methoxy- (9CI)
- DTXSID00822441
- 64543-61-9
- 10-Hydroxy-8-methoxy-2H-phenanthro[3,4-d][1,3]dioxole-5-carboxylic acid
-
- Inchi： 1S/C17H12O6/c1-21-13-5-8(18)4-11-9(13)2-3-10-12(17(19)20)6-14-16(15(10)11)23-7-22-14/h2-6,18H,7H2,1H3,(H,19,20)
- InChI Key： ZDBKDCLMEKCQLS-UHFFFAOYSA-N
- SMILES： O1COC2=CC(C(=O)O)=C3C=CC4C(=CC(=CC=4C3=C12)O)OC
Computed Properties
- Exact Mass: 312.06336
- Monoisotopic Mass: 312.06338810g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 23
- Rotatable Bond Count: 2
- Complexity: 468
- 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: 85.2?2
Experimental Properties
- PSA: 85.22
Phenanthro[4,3-d]-1,3-dioxole-5-carboxylicacid, 10-hydroxy-8-methoxy- Related Literature
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
-
Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
-
Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
-
Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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