Cas no 62615-10-5 (9H-Xanthene-2-methanol, 9-hydroxy-7-methoxy-)
62615-10-5 structure
Product Name:9H-Xanthene-2-methanol, 9-hydroxy-7-methoxy-
CAS No:62615-10-5
MF:C15H14O4
MW:258.269264698029
CID:438150
PubChem ID:21455095
Update Time:2025-04-19
9H-Xanthene-2-methanol, 9-hydroxy-7-methoxy- Chemical and Physical Properties
Names and Identifiers
-
- 9H-Xanthene-2-methanol, 9-hydroxy-7-methoxy-
- 2-(hydroxymethyl)-7-methoxy-9H-xanthen-9-ol
- SCHEMBL11728050
- JVDGELDXGZSWGL-UHFFFAOYSA-N
- 9-Hydroxy-7-methoxy-9H-xanthene-2-methanol
- DTXSID20614224
- 62615-10-5
-
- Inchi： 1S/C15H14O4/c1-18-10-3-5-14-12(7-10)15(17)11-6-9(8-16)2-4-13(11)19-14/h2-7,15-17H,8H2,1H3
- InChI Key： JVDGELDXGZSWGL-UHFFFAOYSA-N
- SMILES： O1C2C=CC(=CC=2C(C2C=C(CO)C=CC1=2)O)OC
Computed Properties
- Exact Mass: 258.08922
- Monoisotopic Mass: 258.08920892g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 19
- Rotatable Bond Count: 2
- Complexity: 309
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.4
- Topological Polar Surface Area: 58.9?2
Experimental Properties
- PSA: 58.92
9H-Xanthene-2-methanol, 9-hydroxy-7-methoxy- Related Literature
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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Xue-Ying Wang,Ying Pei,Min Xie,Zi-He Jin,Ya-Shi Xiao,Yang Wang,Li-Na Zhang,Yan Li,Wei-Hua Huang Lab Chip, 2015,15, 1178-1187
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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