Basic information
- CAS
141-13-9- Standard SMILES
CC(C)=CCCC(C)CCCC(C)C=O- InChIKey
UEGBWDUVDAKUGA-UHFFFAOYSA-N- Molecular formula
- C14H26O
- Average molar mass
- 210.36 g/mol
- Monoisotopic mass
- 210.19836545
Overview
2,6,10-trimethyl-9-undecenal has been reported in Capsicum annuum with data available.
Names & identifiers
- Preferred name
- 2,6,10-Trimethyl-9-undecenal
- IUPAC
- 2,6,10-trimethylundec-9-enal
- English name
- ADOXAL
- Molecular formula
- C14H26O
- Molecular weight
- 210.36
Names & synonyms
Adoxal2,6,10-Trimethylundec-9-enal141-13-9FarenalDoxal9-Undecenal, 2,6,10-trimethyl-2,6,10-Trimethyl-9-undecenalTrimethyl undecylenic aldehyde2,6,10-Trimethyl-9-undecen-1-alJNM5JFE28JEINECS 205-460-8NSC 122698
Show more names
adoxal (Givaudan)ADOXAL NPFARENAL H+RAdoxal 10280012,6,10-trimethyl-9-undecena
AI3-36109NSC-122698J12.264EDTXSID7051711FEMA NO. 4768RefChem:445132DTXCID3030266205-460-8
Database identifiers
- CAS
141-13-9- PubChem CID
- 98403
- DTXSID
DTXSID7051711- UNII
- JNM5JFE28J
- EC Number
- 205-460-8
- Nikkaji
- J12.264E
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 8
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 190
Experimental & physicochemical properties
FragrancesFragrance Ingredient (2,6,10-Trimethyl-9-undecenal) -> IFRA transparency List
Physical DescriptionLiquid
Physicochemical properties
- Melting point
- 15 °C · 15°C (estimate)
- Boiling point
- 299.9 °C · 299.9°C (estimate)
- Density
- 0.8534 · 0.8534 (estimate)
- vapor pressure
- 0.311 Pa · 0.311Pa at 20℃
- refractive index
- 1.4557 · 1.4557 (estimate)
- FEMA
- 4768 · 4768 | 2,6,10-TRIMETHYL-9-UNDECENAL
- Odor
- 1 % · at 1.00 % in dipropylene glycol. fresh aldehydic floral waxy watery
- Odor Type
- aldehydic
- Water Solubility
- 670 μg/L · 670μg/L at 20℃
- Cosmetics Ingredients Functions
- PERFUMING
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 15.9% (261 of 1643) of reports.
Warning
H317 (79.1%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P261, P272, P273, P280, P302+P352, P321, P333+P317, P362+P364, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 1643 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Chemical: 9-Undecenal, 2,6,10-trimethyl-
9-Undecenal, 2,6,10-trimethyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 9-Undecenal, 2,6,10-trimethyl- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
REACH registered substance: 2,6,10-trimethylundec-9-enal (EC: 205-460-8)
9-Undecenal, 2,6,10-trimethyl-: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesSkin Sens. 1B (79.1%)
Safety data
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS09
- Hazard statements
- H410-H400-H317
- REACH Registrations
- Active
- Precautionary statements
- P273-P391-P501-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P273-P391-P501
Chemistry & industry
Uses & manufacturing
U.S. Production2023: 94 lb
Consumer UsesFragrance
Household ProductsInformation on 10 consumer products that contain 2,6,10-Trimethylundec-9-enalââ¬Â¨ in the following categories is provided:
Use ClassificationFragrance Ingredients
General Manufacturing Information9-Undecenal, 2,6,10-trimethyl-: ACTIVE
Applications
UsesPerfume.
Suppliers35 total
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]
Hebei Yanxi Chemical Co., Ltd.+86-17531190177 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
江西林缘香料有限公司13879661494 13879661494 · [email protected]
吉良化学21-62165282 · [email protected]
湖北微斯汀科技有限公司027-61182895 13367240285 · [email protected]
广东大小化工有限公司171603 18666171603 · [email protected]
陕西晶和医药科技有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…