Cas no 35142-05-3 (aristolic acid)
aristolic acid structure
Product Name:aristolic acid
CAS No:35142-05-3
MF:C17H12O5
MW:296.274185180664
CID:919947
PubChem ID:119465
Update Time:2025-04-19
aristolic acid Chemical and Physical Properties
Names and Identifiers
-
- aristolic acid
- 8-methoxynaphtho[2,1-g][1,3]benzodioxole-5-carboxylic acid
- 8-Methoxyphenanthro[3,4-d][1,3]dioxole-5-carboxylic acid
- LS-102936
- CHEMBL486801
- CCRIS 1546
- Q27236906
- 35142-05-3
- SCHEMBL9871957
- WNMKOPJJPJHXJX-UHFFFAOYSA-N
- 1-carboxy-3,4-methylenedioxy-8-methoxyphenanthrene
- BRN 5979107
- DTXSID20956590
- Phenanthro(3,4-d)-1,3-dioxole-5-carboxylic acid, 8-methoxy-
- 8-Methoxy-phenanthro[3,4-d][1,3]dioxole-5-carboxylic acid
- 8-Methoxyphenanthro(3,4-d)-1,3-dioxole-5-carboxylic acid
- 0KM5VL3A48
- 8-Methoxy-2H-phenanthro[3,4-d][1,3]dioxole-5-carboxylic acid
- UNII-0KM5VL3A48
-
- Inchi： 1S/C17H12O5/c1-20-13-4-2-3-10-9(13)5-6-11-12(17(18)19)7-14-16(15(10)11)22-8-21-14/h2-7H,8H2,1H3,(H,18,19)
- InChI Key： WNMKOPJJPJHXJX-UHFFFAOYSA-N
- SMILES： O1COC2=CC(C(=O)O)=C3C=CC4C(=CC=CC=4C3=C12)OC
Computed Properties
- Exact Mass: 296.06846
- Monoisotopic Mass: 296.068473
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 22
- Rotatable Bond Count: 2
- Complexity: 439
- 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: 65
- XLogP3: 3.7
Experimental Properties
- Density: 1.2237 (rough estimate)
- Melting Point: 292°C
- Boiling Point: 357.88°C (rough estimate)
- Flash Point: 210.3°C
- Refractive Index: 1.6200 (estimate)
- PSA: 64.99
aristolic acid Related Literature
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1. An investigation of the electrochemical delithiation process of carbon coated α-Fe2O3nanoparticlesAdrian Brandt,Florian Winter,Sebastian Klamor,Frank Berkemeier,Jatinkumar Rana,Rainer P?ttgen,Andrea Balducci J. Mater. Chem. A, 2013,1, 11229-11236
-
Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
-
José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
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5. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
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