Cas no 839-73-6 (9,10-Anthracenediol, 2-ethyl-)
9,10-Anthracenediol, 2-ethyl- structure
Product Name:9,10-Anthracenediol, 2-ethyl-
CAS No:839-73-6
MF:C16H14O2
MW:238.281164646149
CID:668134
Update Time:2024-02-03
9,10-Anthracenediol, 2-ethyl- Chemical and Physical Properties
Names and Identifiers
-
- 9,10-Anthracenediol, 2-ethyl-
- 2-Ehtylanthrahydroquinone
- 2-ethyl-9,10-anthrahydroquinone
- 2-Ethyl-9,10-anthracenediol
- 2-Ethylanthracene-9,10-diol
-
- Inchi: 1S/C16H14O2/c1-2-10-7-8-13-14(9-10)16(18)12-6-4-3-5-11(12)15(13)17/h3-9,17-18H,2H2,1H3
- InChI Key: JFWDRQJGRFPIIV-UHFFFAOYSA-N
- SMILES: C1=C2C(C(O)=C3C(=C2O)C=CC=C3)=CC=C1CC
Computed Properties
- Exact Mass: 238.099
- Monoisotopic Mass: 238.099
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 1
- Complexity: 291
- 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
Experimental Properties
- Density: 1.271±0.06 g/cm3(Predicted)
- Boiling Point: 484.6±25.0 °C(Predicted)
- pka: 11.23±0.30(Predicted)
9,10-Anthracenediol, 2-ethyl- Related Literature
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Xiaofeng Lin RSC Adv., 2016,6, 9002-9006
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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