データを補完しています。通常は 1 分以内に完了します
基本情報
- CAS
19317-11-4- 標準SMILES
CC(C)=CCCC(C)=CCCC(C)=CC=O- InChIKey
YHRUHBBTQZKMEX-UHFFFAOYSA-N- 分子式
- C15H24O
- 平均分子量
- 220.35 g/mol
- 単同位体質量
- 220.18271539
名称と識別子
- 優先名称
- Farnesal
- IUPAC
- 3,7,11-trimethyldodeca-2,6,10-trienal
名称と別名
名称をさらに表示
データベース識別子
- CAS
19317-11-4- PubChem CID
- 68150
- DTXSID
DTXSID80862062- EC Number
- 242-957-9
物性
構造計算による物性補完中
- XLogP
- 4.9
- 極性表面積
- 17.1 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 1
- 回転可能結合数
- 7
- 重原子数
- 16
- 形式電荷
- 0
- 複雑度
- 289
実験および物理化学的性質
Solubility
Insoluble in water; 50% soluble in heptane, triacetin
soluble (in ethanol)
安全と法規制
GHS分類
GHS Classification
This chemical does not meet GHS hazard criteria for 5.4% (77 of 1439) of reports.
Warning
H315 (94.6%): Causes skin irritation [Warning Skin corrosion/irritation];H317 (91.9%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P261, P264, P272, P280, P302+P352, P321, P332+P317, P333+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 1439 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 77 of 1439 reports by companies.;There are 4 notifications provided by 1362 of 1439 reports by companies with hazard statement code(s).;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
危険有害性情報
Regulatory Information
Chemical: 2,6,10-Dodecatrienal, 3,7,11-trimethyl-
Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
2,6,10-Dodecatrienal, 3,7,11-trimethyl-: Does not have an individual approval but may be used under an appropriate group standard
法規制情報
Regulatory Information
Chemical: 2,6,10-Dodecatrienal, 3,7,11-trimethyl-
Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
2,6,10-Dodecatrienal, 3,7,11-trimethyl-: Does not have an individual approval but may be used under an appropriate group standard
化学と産業
用途と製造
IFRA Fragrance Standards
Farnesal
2,6,10-Dodecatrienal, 3,7,11-trimethyl-; 3,7,11-Trimethyl dodecatrien-2,6,10-al-1; 3,7,11-Trimethyl-2,6,10-dodecatrienal; 3,7,11-Trimethyldodeca-2,6,10-trienal
IFRA_STD_202.pdf
49
IFRA 51st Amendment - Guidance for the use of IFRA Standards
Restriction: This material should be used only in the limited quantity as stated in the Standard
Use Classification
Fragrance Ingredients
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Flavoring Agents -> JECFA Flavorings Index
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Restriction Limits in the Finished Product (%)
0.11 [Products applied to the lips]
0.032 [Products applied to the axillae]
0.11 [Products applied to the face/body using fingertips]
0.6 [Products related to fine fragrances]
0.15 [Products applied to the body using the hands (palms), primarily leave-on (Body lotion)]
0.15 [Products applied to the face using the hands (palms), primarily leave-on (Face moisturizer)]
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