Cas no 570-10-5 (EVERNIC ACID)
EVERNIC ACID structure
Product Name:EVERNIC ACID
EVERNIC ACID Chemical and Physical Properties
Names and Identifiers
-
- EVERNIC ACID
- LECANORIC ACID METHYL ETHER
- 2-Hydroxy-4-methoxy-6-methylbenzoic acid
- 2-HYDROXY-4-[2-HYDROXY-4-METHOXY-6-METHYLBENZOYLOXY]-6-METHYLBENZOIC ACID
- 4-O-Methylorsellinic acid
- Everninic acid
- 2,6-Cresotic acid, 4-methoxy-
- Everninsaure
- CHEBI:191109
- 2-Hydroxy-4-methoxy-6-methyl-benzoic acid
- 5-O-methylorsellinic acid
- CHEMBL1077577
- Spectrum5_001710
- QUCZMUVAQHIOID-UHFFFAOYSA-N
- Benzoic acid, 2-hydroxy-4-methoxy-6-methyl-
- SCHEMBL609931
- DTXSID401346865
- 570-10-5
- CCG-214768
-
- Inchi： 1S/C9H10O4/c1-5-3-6(13-2)4-7(10)8(5)9(11)12/h3-4,10H,1-2H3,(H,11,12)
- InChI Key： QUCZMUVAQHIOID-UHFFFAOYSA-N
- SMILES： O(C)C1C=C(C(C(=O)O)=C(C)C=1)O
Computed Properties
- Exact Mass: 184.03714
- Monoisotopic Mass: 182.05790880g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 192
- 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
- Topological Polar Surface Area: 66.8?2
Experimental Properties
- Density: 1.295±0.06 g/cm3 (20 oC 760 Torr),
- Melting Point: 267 oC
- Solubility: Slightly soluble (1.4 g/l) (25 o C),
- PSA: 86.99
EVERNIC ACID Related Literature
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
-
Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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