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1,1,1-TRIFLUORO-PENTAN-2-ONE structure

1,1,1-TRIFLUORO-PENTAN-2-ONE

CAS：383-56-2
MW:140.105
MF：C5H7F3O

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Names and ldentifier
Properties
Msds
Computational chemical data
Realated Product Infomation

1. Names and Identifiers

1.1 Name: 1,1,1-TRIFLUORO-PENTAN-2-ONE

1.2 Synonyms: [383-56-2]; 1,1,1-Trifluoro-2-pentanone; 1,1,1-TRIFLUORO-PENTAN-2-ONE; 1,1,1-trifluoropentan-2-one; 1,1,1-Trifluoropentan-2-one|1,1,1-Trifluoro-2-pentanone; 2-Pentanone, 1,1,1-trifluoro-; MFCD08275466; NSC 42734;

1.3 CAS No.: 383-56-2

1.4 CID: 238397

1.5 Molecular Formula: C5H7F3O

1.6 Inchi: InChI=1S/C5H7F3O/c1-2-3-4(9)5(6,7)8/h2-3H2,1H3

1.7 InChkey: NOKZRKZHFDRIOJ-UHFFFAOYSA-N

1.8 Canonical Smiles: CCCC(=O)C(F)(F)F

1.9 Isomers Smiles: CCCC(=O)C(F)(F)F

2. Properties

2.1 Solubility: 微溶 (9.4 g/L) (25 oC),

3. MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

no data available

2.2 GHS label elements, including precautionary statements

Pictogram(s)	no data available
Signal word	no data available
Hazard statement(s)	no data available
Precautionary statement(s)
Prevention	no data available
Response	no data available
Storage	no data available
Disposal	no data available

2.3 Other hazards which do not result in classification

no data available

4. Synthesis Route

383-56-2Total: 12 Synthesis Route

141-75-3

141-75-3 102 Suppliers

383-56-2

383-56-2 6 Suppliers

3854-50-0

3854-50-0 4 Suppliers

383-56-2

383-56-2 6 Suppliers

5. Precursor and Product

precursor:

353-85-5

353-85-5

383-63-1

383-63-1

106-94-5

106-94-5

495-40-9

495-40-9

90550-11-1

90550-11-1

3854-50-0

3854-50-0

76-05-1

76-05-1

106-31-0

106-31-0

431-47-0

431-47-0

75-63-8

75-63-8

141-75-3

141-75-3

6. Computed Properties

Molecular Weight：140.105g/mol
Molecular Formula：C₅H₇F₃O
Compound Is Canonicalized：True
Exact Mass：1.9
XLogP3-AA：140.04489933
Monoisotopic Mass：140.04489933
Complexity：105
Rotatable Bond Count：2
Hydrogen Bond Donor Count：0
Hydrogen Bond Acceptor Count：4
Topological Polar Surface Area：17.1
Heavy Atom Count：：9
Defined Atom Stereocenter Count：0
Undefined Atom Stereocenter Count：0
Defined Bond Stereocenter Count：0
Undefined Bond Stereocenter Count：0
Isotope Atom Count：0
Covalently-Bonded Unit Count：1
CACTVS Substructure Key Fingerprint：AAADcYBgIYAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGwAAAAAACASAgBACAAAAAAAIAIAQAAAAAAAAAAAAAAEAAAAAABIAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

7. Toltal 5 Suppliers View more

1,1,1-Trifluoro-pentan-2-one

Shanghai Sinch Parmaceuticals Tech. Co. Ltd.

Tel: Update Time:2019/11/25

inquire

1,1,1-TRIFLUORO-PENTAN-2-ONE

Oakwood Products, Inc.

Tel: Update Time:2019/11/25

inquire

2-Pentanone,1,1,1-trifluoro-

Shanghai Clean Chemical Technology Corp Ltd

Tel: Update Time:2010/12/18

inquire

1,1,1-TRIFLUORO-PENTAN-2-ONE

Oakwood Products, Inc.

Tel: Update Time:2022/01/01

inquire

1,1,1-TRIFLUORO-PENTAN-2-ONE

Fluorochem Ltd.

Tel: Update Time:2022/01/01

inquire

8. Realated Product Infomation

1. Names and Identifiers

1.1 Name
1.2 Synonyms
1.3 CAS No.
1.4 Molecular Formula
1.5 Inchi
1.6 InChkey
1.7 Canonical Smiles
1.8 Isomers Smiles

2. Properties

2.1 Solubility

4. Synthesis Route

5. Precursor and Product

6. Computational chemical data

7. Toltal 5 Suppliers

8. Realated Product Infomation

CAS Products Suppliers

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