Cas no 6292-88-2 (5-[(5-bromofuran-2-yl)methylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione)
6292-88-2 structure
Product Name:5-[(5-bromofuran-2-yl)methylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione
CAS No:6292-88-2
MF:C13H22ClNO
MW:243.772882938385
CID:958310
PubChem ID:222909
Update Time:2025-04-19
5-[(5-bromofuran-2-yl)methylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione Chemical and Physical Properties
Names and Identifiers
-
- 5-[(5-bromofuran-2-yl)methylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione
- Dicyclohexyl carbamoyl chloride
- 6292-88-2
- NSC9971
- AKOS018445526
- NSC-9971
- dicyclohexylcarbamoyl chloride
- KWWWNZDDRYZJGJ-UHFFFAOYSA-N
- Dicyclohexylcarbamyl chloride
- SCHEMBL372541
- DTXSID80978738
-
- Inchi: 1S/C13H22ClNO/c14-13(16)15(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h11-12H,1-10H2
- InChI Key: KWWWNZDDRYZJGJ-UHFFFAOYSA-N
- SMILES: ClC(N(C1CCCCC1)C1CCCCC1)=O
Computed Properties
- Exact Mass: 342.01025
- Monoisotopic Mass: 243.139
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 214
- 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: 4.4
- Topological Polar Surface Area: 20.3?2
Experimental Properties
- Density: 1.446
- Boiling Point: 508.6°C at 760 mmHg
- Flash Point: 261.4°C
- Refractive Index: 1.551
- PSA: 65.74
5-[(5-bromofuran-2-yl)methylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione Related Literature
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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Raktani Bikshapathi,Sai Prathima Parvathaneni,Vaidya Jayathirtha Rao Green Chem., 2017,19, 4446-4450
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