Cas no 7509-41-3 (Nsc407386)
Nsc407386 structure
Product Name:Nsc407386
Nsc407386 Chemical and Physical Properties
Names and Identifiers
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- Nsc407386
- AC1L92WO
- NSC-407386
- DTXSID20331303
- 7509-41-3
-
- Inchi： 1S/C12H14O/c13-12-8-3-7-10-5-1-4(9(8)10)2-6(5)11(7)12/h4-11H,1-3H2
- InChI Key： NJFUQXNWKMHBSN-UHFFFAOYSA-N
- SMILES： O=C1C2CC3C1C1CC4CC1C3C42
Computed Properties
- Exact Mass: 174.10400
- Monoisotopic Mass: 174.104
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 0
- Complexity: 334
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 8
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.8
- Topological Polar Surface Area: 17.1?2
Experimental Properties
- Density: 1.305
- Boiling Point: 301.6°C at 760 mmHg
- Flash Point: 128.6°C
- Refractive Index: 1.633
- PSA: 17.07000
- LogP: 1.72340
Nsc407386 Related Literature
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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