Cas no 72845-79-5 (2-Propanone,1-(1-oxopropoxy)-)
2-Propanone,1-(1-oxopropoxy)- structure
Product Name:2-Propanone,1-(1-oxopropoxy)-
CAS No:72845-79-5
MF:C6H10O3
MW:130.141802310944
CID:572929
PubChem ID:3085860
Update Time:2025-04-19
2-Propanone,1-(1-oxopropoxy)- Chemical and Physical Properties
Names and Identifiers
-
- 2-Propanone,1-(1-oxopropoxy)-
- 2-oxopropyl propanoate
- 2-Propanone, 1-(1-oxopropoxy)- (9CI)
- 2-Oxopropyl propionate
- 2-Propanone, 1-(1-oxopropoxy)-
- 72845-79-5
- DTXSID7072620
- propionyloxyacetone
- SCHEMBL946642
- 1-(Propionyloxy)-2-propanon
- Acetol propionate
-
- Inchi： 1S/C6H10O3/c1-3-6(8)9-4-5(2)7/h3-4H2,1-2H3
- InChI Key： QCSKTFWPHGNBOR-UHFFFAOYSA-N
- SMILES： O(C(CC)=O)CC(C)=O
Computed Properties
- Exact Mass: 130.063
- Monoisotopic Mass: 130.063
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 9
- Rotatable Bond Count: 4
- Complexity: 118
- 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: 0.3
- Topological Polar Surface Area: 43.4?2
Experimental Properties
- Density: 1.015
- Boiling Point: 171°C at 760 mmHg
- Flash Point: 61.2°C
- Refractive Index: 1.408
- PSA: 43.37
2-Propanone,1-(1-oxopropoxy)- Related Literature
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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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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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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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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