Cas no 101650-18-4 (1,3-Dioxolane,2-(3-bromopropyl)-2-propyl-)
101650-18-4 structure
Product Name:1,3-Dioxolane,2-(3-bromopropyl)-2-propyl-
CAS No:101650-18-4
MF:C9H17BrO2
MW:237.134082555771
CID:124708
PubChem ID:53925780
Update Time:2025-04-18
1,3-Dioxolane,2-(3-bromopropyl)-2-propyl- Chemical and Physical Properties
Names and Identifiers
-
- 1,3-Dioxolane,2-(3-bromopropyl)-2-propyl-
- 1-BROMO-3-ETHYLENEDIOXY-HEPTANE
- 2-(2-bromoethyl)-3-propyl-1,4-dioxane
- 2-(3-bromopropyl)-2-propyl-1,3-dioxolane
- bromo-7 heptanone-4 ethylene-acetal
- INRNFOINQWRSFI-UHFFFAOYSA-N
- SCHEMBL6739159
- 101650-18-4
-
- Inchi： 1S/C9H17BrO2/c1-2-4-9(5-3-6-10)11-7-8-12-9/h2-8H2,1H3
- InChI Key： INRNFOINQWRSFI-UHFFFAOYSA-N
- SMILES： BrCCCC1(CCC)OCCO1
Computed Properties
- Exact Mass: 236.04100
- Monoisotopic Mass: 236.041
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 4
- Complexity: 119
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 18.5A^2
- XLogP3: 2.4
Experimental Properties
- PSA: 18.46000
- LogP: 2.70470
1,3-Dioxolane,2-(3-bromopropyl)-2-propyl- Related Literature
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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Marta Liras,Isabel Quijada-Garrido,Marta Palacios-Cuesta,Sonia Mu?oz-Durieux,Olga García Polym. Chem., 2014,5, 433-442
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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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