Cas no 39559-42-7 (10-hydroxyphenanthren-9-yl acetate)
39559-42-7 structure
Product Name:10-hydroxyphenanthren-9-yl acetate
CAS No:39559-42-7
MF:C16H12O3
MW:252.264684677124
CID:924683
PubChem ID:101353
Update Time:2025-04-19
10-hydroxyphenanthren-9-yl acetate Chemical and Physical Properties
Names and Identifiers
-
- 10-hydroxyphenanthren-9-yl acetate
- (10-hydroxyphenanthren-9-yl) acetate
- 10-Hydroxy-9-phenanthryl acetate
- 9,10-phenanthrenediol, monoacetate
- 9,10-Phenanthrenediol monoacetate
- NSC407893
- DTXSID60192672
- 9, monoacetate
- UNII-US5FT8N1TO
- NSC 407893
- 9,10-PHENANTHRENEDIOL, 9-ACETATE
- (10-hydroxy-9-phenanthryl) acetate
- BRN 1982468
- NSC-407893
- US5FT8N1TO
- 3-06-00-05691 (Beilstein Handbook Reference)
- 39559-42-7
-
- Inchi： 1S/C16H12O3/c1-10(17)19-16-14-9-5-3-7-12(14)11-6-2-4-8-13(11)15(16)18/h2-9,18H,1H3
- InChI Key： MKAILPKBUQHGKH-UHFFFAOYSA-N
- SMILES： O(C(C)=O)C1C(=C2C=CC=CC2=C2C=CC=CC2=1)O
Computed Properties
- Exact Mass: 252.07866
- Monoisotopic Mass: 252.078644241g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 19
- Rotatable Bond Count: 2
- Complexity: 341
- 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: 3.8
- Topological Polar Surface Area: 46.5?2
Experimental Properties
- PSA: 46.53
10-hydroxyphenanthren-9-yl acetate Related Literature
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
-
Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
-
Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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