Cas no 17012-91-8 (Methanediol,1-benz[a]anthracen-7-yl-, 1,1-diacetate)
![Methanediol,1-benz[a]anthracen-7-yl-, 1,1-diacetate structure](https://ossimg.kuujia.com/scimg/17500/17012-91-8x500.png)
17012-91-8 structure
Product Name:Methanediol,1-benz[a]anthracen-7-yl-, 1,1-diacetate
CAS No:17012-91-8
MF:C23H18O4
MW:358.386626720428
CID:195906
PubChem ID:86904
Update Time:2025-04-19
Methanediol,1-benz[a]anthracen-7-yl-, 1,1-diacetate Chemical and Physical Properties
Names and Identifiers
-
- Methanediol,1-benz[a]anthracen-7-yl-, 1,1-diacetate
- [acetyloxy(benzo[a]anthracen-7-yl)methyl] acetate
- 7-(Diacetoxymethyl)benz[a]anthracene
- 17012-91-8
- Benz(a)anthracene-7-methanediol, diacetate
- [Acetyloxy(benzo[b]phenanthren-7-yl)methyl]acetate
- A811491
- [acetoxy(benzo[a]anthracen-7-yl)methyl] acetate;DIMETHYL 1,10-DECANEDICARBOXYLATE
- DTXSID50168801
- 7-Diacetoxymethylbenz(a)anthracene
-
- Inchi： 1S/C23H18O4/c1-14(24)26-23(27-15(2)25)22-19-10-6-4-8-17(19)13-21-18-9-5-3-7-16(18)11-12-20(21)22/h3-13,23H,1-2H3
- InChI Key： LRTXBMQWXYFKCR-UHFFFAOYSA-N
- SMILES： O(C(C)=O)C(C1C2C=CC=CC=2C=C2C3C=CC=CC=3C=CC=12)OC(C)=O
Computed Properties
- Exact Mass: 358.12054
- Monoisotopic Mass: 358.12050905g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 27
- Rotatable Bond Count: 5
- Complexity: 543
- 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: 5.4
- Topological Polar Surface Area: 52.6?2
Experimental Properties
- Density: 1.1625 (rough estimate)
- Boiling Point: 450.82°C (rough estimate)
- Refractive Index: 1.6000 (estimate)
- PSA: 52.6
Methanediol,1-benz[a]anthracen-7-yl-, 1,1-diacetate Related Literature
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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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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
17012-91-8 (Methanediol,1-benz[a]anthracen-7-yl-, 1,1-diacetate) Related Products
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