| Identification | More | [Name]
3-HEPTEN-2-ONE | [CAS]
1119-44-4 | [Synonyms]
3-HEPTEN-2-ONE
FEMA 3400
METHYL PENTENYL KETONE
hept-3-en-2-one | [EINECS(EC#)]
214-278-8 | [Molecular Formula]
C7H12O | [MDL Number]
MFCD00015564 | [Molecular Weight]
112.17 | [MOL File]
1119-44-4.mol |
| Chemical Properties | Back Directory | [Boiling point ]
63°C 13mm | [density ]
0,86 g/cm3 | [FEMA ]
3400 | [refractive index ]
1.4450 | [Fp ]
49°C | [storage temp. ]
Storage temp. 2-8°C | [form ]
clear liquid | [color ]
Colorless to Light yellow to Light orange | [Odor]
at 10.00 % in dipropylene glycol. green grassy caraway | [Odor Type]
green | [Water Solubility ]
Soluble in alcohol and slightly soluble in water(3087 mg/L @ 25°C (est.)) | [JECFA Number]
1127 | [BRN ]
1739239 | [InChI]
1S/C7H12O/c1-3-4-5-6-7(2)8/h5-6H,3-4H2,1-2H3/b6-5+ | [InChIKey]
JHHZQADGLDKIPM-AATRIKPKSA-N | [SMILES]
CCC\C=C\C(C)=O | [LogP]
1.63 | [CAS DataBase Reference]
1119-44-4(CAS DataBase Reference) | [EPA Substance Registry System]
3-Hepten-2-one (1119-44-4) |
| Safety Data | Back Directory | [Symbol(GHS) ]
GHS02 | [Signal word ]
Warning | [Hazard statements ]
H226 | [Precautionary statements ]
P210-P240-P241-P280a-P303+P361+P353-P501a | [Hazard Codes ]
F,Xi | [Risk Statements ]
R10:Flammable. | [Safety Statements ]
S16:Keep away from sources of ignition-No smoking . | [RIDADR ]
1224 | [WGK Germany ]
3 | [TSCA ]
Yes | [HazardClass ]
3 | [PackingGroup ]
III | [HS Code ]
2914199090 | [Storage Class]
3 - Flammable liquids | [Hazard Classifications]
Eye Irrit. 2
Flam. Liq. 3
Skin Irrit. 2
STOT SE 3 |
| Questions and Answers (Q&A) | Back Directory | [Description]
3-Hepten-2-one is a kind of ketone derivative that can be used as a
favoring and fragrance agents. 3-Hepten-2-one belongs to the family
of Acryloyl Compounds. It has a powerful, green grassy and caraway
odor. It can be used to supply a green note to fruity compositions.
It has creamy flavor to be used as caraway, passion fruit and
pineapple flavors. This ketone can provide lingering rich after-
notes to dairy product such as custard, melted butter, creams and
cheers. It is also useful in fatty nut application such as Brazil
and pine nuts. It is also useful for the production of heptan-2-one. | [References]
https://pubchem.ncbi.nlm.nih.gov/compound/5364578#section=2D- Structure
http://www.thegoodscentscompany.com/data/rw1008511.html
https://www.alfa.com/en/catalog/A19086/
|
| Hazard Information | Back Directory | [Chemical Properties]
3-Hepten-2-one has a powerful green-grassy, pungent odor. It may
be synthesized by reacting 1-pentyne with acetic anhydride to yield
3-heptyn-2-one, which is then converted to cis-3-hepten-2-one by
partial catalytic hydrogenation; the trans-form is probably
obtained from trans-2 -hexenic acid treated with methyl lithium. | [Chemical Properties]
3-Hepten-2-one has a powerful, green-grassy, pungent odor. | [Occurrence]
Reported found in (Byrsinoma crassifolia), red and green pepper, capsicum varieties, hop oil and roasted flbert | [Uses]
It is used in most dairy flavors to add greater depth. This ketone will add lingering rich after-notes, to many processed dairy products such as custard, melted butter, creams and cheeses (Brie, Gorgonzola and blue cheeses). Also beneficial in fatty nut applications (brazil and pine nuts, cashews). It is also used to produce Heptan-2-one. | [Definition]
ChEBI: 3-Hepten-2-one is an enone. | [Preparation]
By reacting 1-pentyne with acetic anhydride to yield 3-heptyn-2-one, which is then converted to cis-3-hepten-2-one by partial catalytic hydrogenation; the trans-form is probably obtained from trans-2-hexenic acid treated with methyl lithium. | [Aroma threshold values]
Detection: 56 ppb; aroma characteristics at 1.0%: pungent, dairy, creamy, slightly ketonic, sour milky, blue cheese, waxy, earthy mushroom. | [Taste threshold values]
Taste characteristics at 5 ppm: creamy, dairy, waxy, stale milky, blue cheese and cheese rind with ripe, slightly moldly stale milk with a good mouthfeel. |
|
| Company Name: |
J & K SCIENTIFIC LTD.
|
| Telephone: |
18210857532 18210857532 |
| Website: |
https://www.jkchemical.com |
| Company Name: |
Alfa Aesar
|
| Telephone: |
400-6106006 |
| Website: |
http://chemicals.thermofisher.cn |
| Company Name: |
Energy Chemical
|
| Telephone: |
400-0056266 |
| Website: |
www.energy-chemical.com |
| Company Name: |
Maya High Purity Chemicals
|
| Telephone: |
+86 (573) 82222445 (0)18006601000 452520369 |
| Website: |
www.chemicalbook.com/ShowSupplierProductsList15221/0_EN.htm |
|