Cas no 145917-93-7 (2H-1-Benzopyran-6,7-diol,3-(4-hydroxyphenyl)-)
145917-93-7 structure
Product Name:2H-1-Benzopyran-6,7-diol,3-(4-hydroxyphenyl)-
CAS No:145917-93-7
MF:C15H12O4
MW:256.253384590149
CID:105831
PubChem ID:2763154
Update Time:2025-04-18
2H-1-Benzopyran-6,7-diol,3-(4-hydroxyphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2H-1-Benzopyran-6,7-diol,3-(4-hydroxyphenyl)-
- 3-(4-HYDROXYPHENYL)-2H-1-BENZOPYRAN-6,7-DIOL
- 3-(4-hydroxyphenyl)-2H-chromene-6,7-diol
- 2H-1-Benzopyran-6,7-diol,3-(4-hydroxyphenyl)
- AKOS015908525
- 145917-93-7
- FT-0738523
- SCHEMBL677785
- DTXSID70376769
-
- Inchi： 1S/C15H12O4/c16-12-3-1-9(2-4-12)11-5-10-6-13(17)14(18)7-15(10)19-8-11/h1-7,16-18H,8H2
- InChI Key： DPGRBFWWYBMPIF-UHFFFAOYSA-N
- SMILES： O1C2C=C(C(=CC=2C=C(C2C=CC(=CC=2)O)C1)O)O
Computed Properties
- Exact Mass: 256.07400
- Monoisotopic Mass: 256.074
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 19
- Rotatable Bond Count: 1
- Complexity: 346
- 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: 2.4
- Topological Polar Surface Area: 69.9?2
Experimental Properties
- Density: 1.439
- Boiling Point: 526.8°C at 760 mmHg
- Flash Point: 272.4°C
- Refractive Index: 1.711
- PSA: 69.92000
- LogP: 2.73640
2H-1-Benzopyran-6,7-diol,3-(4-hydroxyphenyl)- Related Literature
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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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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3. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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