Cas no 31637-00-0 (2-Decanol, 2-benzoate)
2-Decanol, 2-benzoate structure
Product Name:2-Decanol, 2-benzoate
CAS No:31637-00-0
MF:C17H26O2
MW:262.387145519257
CID:299896
PubChem ID:90471467
Update Time:2025-04-19
2-Decanol, 2-benzoate Chemical and Physical Properties
Names and Identifiers
-
- 2-Decanol, 2-benzoate
- 2-decanol, benzoate
- Decan-2-yl benzoate
- LogP
- 31637-00-0
- 2-Decanol,benzoate
- WPQGCBLKSNYZOU-UHFFFAOYSA-N
- Benzoic acid, dec-2-yl ester
-
- Inchi： 1S/C17H26O2/c1-3-4-5-6-7-9-12-15(2)19-17(18)16-13-10-8-11-14-16/h8,10-11,13-15H,3-7,9,12H2,1-2H3
- InChI Key： WPQGCBLKSNYZOU-UHFFFAOYSA-N
- SMILES： O(C(C1C=CC=CC=1)=O)C(C)CCCCCCCC
Computed Properties
- Exact Mass: 262.19338
- Monoisotopic Mass: 262.193280068g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 19
- Rotatable Bond Count: 10
- Complexity: 231
- 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: 6.8
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- Density: 0.95
- Boiling Point: 345.886°C at 760 mmHg
- Flash Point: 145.945°C
- Refractive Index: 1.489
- PSA: 26.3
2-Decanol, 2-benzoate Related Literature
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Sheng Wang,Wenxian Xie,Xiu Zhang,Xia Zou,Yan Zhang Chem. Commun., 2012,48, 5907-5909
31637-00-0 (2-Decanol, 2-benzoate) Related Products
- 2412-73-9(Cyclohexyl benzoate)
- 131-15-7(Disecoctyl Phthalate)
- 2049-96-9(Pentyl benzoate)
- 23510-95-4(4-Oxocyclohexyl benzoate)
- 84-61-7(Dicyclohexyl phthalate)
- 6789-88-4(Hexyl benzoate)
- 94-50-8(Octyl benzoate)
- 2915-72-2(Dodecyl benzoate)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
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