Cas no 40463-15-8 ( )
structure
Product Name:
Chemical and Physical Properties
Names and Identifiers
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- 1,4,4-trimethyl-2,3-dihydro-1H-naphthalene
- 1,1,4-trimethyl-1,2,3,4-tetrahydronaphthalene
- 1,1,4-trimethyl-1,2,3,4-tetrahydro-naphthalene
- 1,1,4-Trimethyl-1,2,3,4-tetrahydro-naphthalin
- 1,1,4-trimethyltetralin
- 1,1,4-trimethyl-tetralin
- 1,4,4-Trimethyl-tetrahydronaphthalin
- AC1L5EQJ
- AC1Q1HJT
- AR-1B4087
- CTK1D7244
- KST-1B4961
- NSC16799
- 1,2,3,4-tetrahydro-1,1,4-trimethylnaphthalene
- DTXSID70280433
- 40463-15-8
- NSC-16799
-
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- Inchi： 1S/C13H18/c1-10-8-9-13(2,3)12-7-5-4-6-11(10)12/h4-7,10H,8-9H2,1-3H3
- InChI Key： BMTDAHMAKSGQIT-UHFFFAOYSA-N
- SMILES： C1(C)(C)C2C=CC=CC=2C(C)CC1
Computed Properties
- Exact Mass: 174.141
- Monoisotopic Mass: 174.141
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 13
- Rotatable Bond Count: 0
- Complexity: 181
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.5
- Topological Polar Surface Area: 0?2
Experimental Properties
- Density: 0.895
- Boiling Point: 241.6°C at 760 mmHg
- Flash Point: 94.6°C
- Refractive Index: 1.498
Related Literature
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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2. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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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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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Jason Wan Lab Chip, 2020,20, 4528-4538
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