Cas no 114570-33-1 (9H-xanthene-3,9-diol)
9H-xanthene-3,9-diol structure
Product Name:9H-xanthene-3,9-diol
CAS No:114570-33-1
MF:C13H10O3
MW:214.216703891754
CID:2613112
PubChem ID:71338438
Update Time:2025-04-21
9H-xanthene-3,9-diol Chemical and Physical Properties
Names and Identifiers
-
- 9H-xanthene-3,9-diol
- 114570-33-1
- DTXSID70766020
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- Inchi： 1S/C13H10O3/c14-8-5-6-10-12(7-8)16-11-4-2-1-3-9(11)13(10)15/h1-7,13-15H
- InChI Key： LWZQNDWBRMJROX-UHFFFAOYSA-N
- SMILES： O1C2C=CC=CC=2C(C2C=CC(=CC1=2)O)O
Computed Properties
- Exact Mass: 214.062994177Da
- Monoisotopic Mass: 214.062994177Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 0
- Complexity: 256
- 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: 2
- Topological Polar Surface Area: 49.7?2
9H-xanthene-3,9-diol Related Literature
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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