Cas no 27413-67-8 (Ethanone,1-(5,6,7,8-tetrahydro-3,5,8,8-tetramethyl-2-naphthalenyl)-)
27413-67-8 structure
Product Name:Ethanone,1-(5,6,7,8-tetrahydro-3,5,8,8-tetramethyl-2-naphthalenyl)-
CAS No:27413-67-8
MF:C16H22O
MW:230.345284938812
CID:265278
PubChem ID:226696
Update Time:2025-04-19
Ethanone,1-(5,6,7,8-tetrahydro-3,5,8,8-tetramethyl-2-naphthalenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Ethanone,1-(5,6,7,8-tetrahydro-3,5,8,8-tetramethyl-2-naphthalenyl)-
- 1-(3,5,8,8-tetramethyl-6,7-dihydro-5H-naphthalen-2-yl)ethanone
- NSC17408
- 27413-67-8
- NSC-17408
-
- Inchi： 1S/C16H22O/c1-10-6-7-16(4,5)15-9-13(12(3)17)11(2)8-14(10)15/h8-10H,6-7H2,1-5H3
- InChI Key： YLPKSUJWHRYFGX-UHFFFAOYSA-N
- SMILES： O=C(C)C1C(C)=CC2=C(C=1)C(C)(C)CCC2C
Computed Properties
- Exact Mass: 230.16716
- Monoisotopic Mass: 230.167
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 17
- Rotatable Bond Count: 1
- Complexity: 305
- 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: 4.6
- Topological Polar Surface Area: 17.1?2
Experimental Properties
- Density: 0.949
- Boiling Point: 346.3°Cat760mmHg
- Flash Point: 147°C
- Refractive Index: 1.505
- PSA: 17.07
- LogP: 4.37250
Ethanone,1-(5,6,7,8-tetrahydro-3,5,8,8-tetramethyl-2-naphthalenyl)- 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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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
27413-67-8 (Ethanone,1-(5,6,7,8-tetrahydro-3,5,8,8-tetramethyl-2-naphthalenyl)-) Related Products
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