Cas no 57374-16-0 (2,9-Anthracenediol, 10-[4-(acetyloxy)phenyl]-, diacetate)
57374-16-0 structure
Product Name:2,9-Anthracenediol, 10-[4-(acetyloxy)phenyl]-, diacetate
CAS No:57374-16-0
MF:C26H24O8
MW:464.463968276978
CID:345572
PubChem ID:71444166
Update Time:2025-04-19
2,9-Anthracenediol, 10-[4-(acetyloxy)phenyl]-, diacetate Chemical and Physical Properties
Names and Identifiers
-
- 2,9-Anthracenediol, 10-[4-(acetyloxy)phenyl]-, diacetate
- acetic acid,[4-(3,10-dihydroxyanthracen-9-yl)phenyl] acetate
- DTXSID40852964
- Acetic acid--4-(3,10-dihydroxyanthracen-9-yl)phenyl acetate (2/1)
- 57374-16-0
-
- Inchi: 1S/C22H16O4.2C2H4O2/c1-13(23)26-16-9-6-14(7-10-16)21-17-4-2-3-5-19(17)22(25)20-12-15(24)8-11-18(20)21;2*1-2(3)4/h2-12,24-25H,1H3;2*1H3,(H,3,4)
- InChI Key: OCFYUHXQFPVONI-UHFFFAOYSA-N
- SMILES: OC1C2C=CC=CC=2C(C2C=CC(=CC=2)OC(C)=O)=C2C=CC(=CC2=1)O.OC(C)=O.OC(C)=O
Computed Properties
- Exact Mass: 464.14712
- Monoisotopic Mass: 464.14711772g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 34
- Rotatable Bond Count: 3
- Complexity: 529
- Covalently-Bonded Unit Count: 3
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 141?2
Experimental Properties
- PSA: 141.36
2,9-Anthracenediol, 10-[4-(acetyloxy)phenyl]-, diacetate Related Literature
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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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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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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