Cas no 38165-75-2 (9(10H)-Anthracenone,1,8-bis(acetyloxy)-)
38165-75-2 structure
Product Name:9(10H)-Anthracenone,1,8-bis(acetyloxy)-
CAS No:38165-75-2
MF:C18H14O5
MW:310.300765514374
CID:318605
PubChem ID:3084693
Update Time:2025-04-19
9(10H)-Anthracenone,1,8-bis(acetyloxy)- Chemical and Physical Properties
Names and Identifiers
-
- 9(10H)-Anthracenone,1,8-bis(acetyloxy)-
- 2-[8-(carboxymethyl)-9-oxo-10H-anthracen-1-yl]acetic acid
- 38165-75-2
- DTXSID70191550
- 9(10H)-Anthracenone, 1,8-bis(acetyloxy)-
-
- Inchi： 1S/C18H14O5/c19-14(20)8-12-5-1-3-10-7-11-4-2-6-13(9-15(21)22)17(11)18(23)16(10)12/h1-6H,7-9H2,(H,19,20)(H,21,22)
- InChI Key： KPCFDDJXJDHKNH-UHFFFAOYSA-N
- SMILES： O=C1C2C(CC(=O)O)=CC=CC=2CC2C=CC=C(CC(=O)O)C=21
Computed Properties
- Exact Mass: 310.08412
- Monoisotopic Mass: 310.08412354g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 23
- Rotatable Bond Count: 4
- Complexity: 458
- 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: 2.3
- Topological Polar Surface Area: 91.7?2
Experimental Properties
- PSA: 91.67
9(10H)-Anthracenone,1,8-bis(acetyloxy)- 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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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
-
Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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