Cas no 112947-60-1 (1,2,3,4,5,6,7,8-octakis(dichloromethyl)anthracene)
112947-60-1 structure
Product Name:1,2,3,4,5,6,7,8-octakis(dichloromethyl)anthracene
CAS No:112947-60-1
MF:C22H10Cl16
MW:841.562791347504
CID:2609820
PubChem ID:71336895
Update Time:2025-04-21
1,2,3,4,5,6,7,8-octakis(dichloromethyl)anthracene Chemical and Physical Properties
Names and Identifiers
-
- 1,2,3,4,5,6,7,8-octakis(dichloromethyl)anthracene
- 112947-60-1
- DTXSID30764663
-
- Inchi： 1S/C22H10Cl16/c23-15(24)7-3-1-4-6(2-5(3)9(17(27)28)13(21(35)36)11(7)19(31)32)10(18(29)30)14(22(37)38)12(20(33)34)8(4)16(25)26/h1-2,15-22H
- InChI Key： LIDFSJWNUZOPLN-UHFFFAOYSA-N
- SMILES： ClC(C1C(C(Cl)Cl)=C(C(Cl)Cl)C(C(Cl)Cl)=C2C=C3C(C(Cl)Cl)=C(C(Cl)Cl)C(C(Cl)Cl)=C(C(Cl)Cl)C3=CC2=1)Cl
Computed Properties
- Exact Mass: 841.568093Da
- Monoisotopic Mass: 833.579893Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 38
- Rotatable Bond Count: 8
- Complexity: 638
- 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: 13.3
- Topological Polar Surface Area: 0?2
1,2,3,4,5,6,7,8-octakis(dichloromethyl)anthracene Related Literature
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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