Cas no 25491-41-2 (2,4-Pentanedione, 3-acetyl-3-methyl-)
25491-41-2 structure
Product Name:2,4-Pentanedione, 3-acetyl-3-methyl-
CAS No:25491-41-2
MF:C8H12O3
MW:156.179082870483
CID:1425751
PubChem ID:12131181
Update Time:2025-04-20
2,4-Pentanedione, 3-acetyl-3-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 2,4-Pentanedione, 3-acetyl-3-methyl-
- 3-acetyl-3-methylpentane-2,4-dione
- DTXSID70478191
- 25491-41-2
- SCHEMBL374099
- SFWVCXDETAFGMA-UHFFFAOYSA-N
-
- Inchi: 1S/C8H12O3/c1-5(9)8(4,6(2)10)7(3)11/h1-4H3
- InChI Key: SFWVCXDETAFGMA-UHFFFAOYSA-N
- SMILES: O=C(C)C(C(C)=O)(C(C)=O)C
Computed Properties
- Exact Mass: 156.07866
- Monoisotopic Mass: 156.078644241g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 3
- Complexity: 179
- 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: 0.1
- Topological Polar Surface Area: 51.2?2
Experimental Properties
- PSA: 51.21
2,4-Pentanedione, 3-acetyl-3-methyl- Related Literature
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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4. 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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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
25491-41-2 (2,4-Pentanedione, 3-acetyl-3-methyl-) Related Products
- 1540-34-7(3-Ethyl-2,4-pentanedione)
- 18362-64-6(2,6-Dimethyl-3,5-heptanedione)
- 1118-71-4(Dipivaloylmethane)
- 20669-04-9(3,3-Dimethylpentan-2-one)
- 113486-29-6(3-Methylnonane-2,4-dione (>80%))
- 933-52-8(tetramethylcyclobutane-1,3-dione)
- 1540-36-9(3-n-Butyl-2,4-pentanedione)
- 7307-04-2(5,5-Dimethylhexane-2,4-dione)
- 5405-79-8(2,2-Dimethyl-3-hexanone)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
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