Basic information
- CAS
103-20-8- Standard SMILES
CCCCC(CC)CCC(O)CC(C)C- InChIKey
JKKBSZCOVNFRCQ-UHFFFAOYSA-N- Molecular formula
- C14H30O
- Average molar mass
- 214.39 g/mol
- Monoisotopic mass
- 214.22966558
Names & identifiers
- Preferred name
- 7-Ethyl-2-methyl-4-undecanol
- IUPAC
- 7-ethyl-2-methylundecan-4-ol
- English name
- 7-Ethyl-2-methyl-4-undecanol
- Molecular formula
- C14H30O
- Molecular weight
- 214.39
Names & synonyms
7-Ethyl-2-methyl-4-undecanol103-20-84-Undecanol, 7-ethyl-2-methyl-DTXSID80883292RefChem:106068DTXCID101022834203-088-07-Ethyl-2-methylundecan-4-ol7-Ethyl-2-methyl-4-hendecanolMFCD00027253NSC60591EINECS 203-088-0
Show more names
TETRADECANOLNsc 60591Ethylmethylundecanol7-ethyl-2-methyl-4-undecano2-Methyl-7-ethylundecane-4-ol
SCHEMBL7009642-Methyl-7-ethyl-4-undecanolNSC-60591LS-14361CS-0198842D904434-Undecanol,7-ethyl-2-methyl-7-ethyl-2-methyl-undecan-4-ol
Database identifiers
- CAS
103-20-8- PubChem CID
- 97948
- DTXSID
DTXSID80883292- EC Number
- 203-088-0
- Nikkaji
- J105.209H
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 9
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 131
Experimental & physicochemical properties
SpringerMaterials PropertiesDensity
Physicochemical properties
- Boiling point
- 261 · 261-262 °C
- Density
- 0 · 0,84 g/cm3
- refractive index
- 1.443 to · 1.4430 to 1.4460
- storage temp.
- 2 · 2-8°C
- form
- clear liquid
- pka
- 15.24 · 15.24±0.20(Predicted)
- color
- Colorless to Almost colorless
- Dielectric constant
- 4.7 · 4.7(38℃)
- InChI
- InChI=1S/C14H30O/c1-5-7-8-13(6-2)9-10-14(15)11-12(3)4/h12-15H,5-11H2,1-4H3
- InChIKey
- JKKBSZCOVNFRCQ-UHFFFAOYSA-N
- SMILES
- CC(C)CC(O)CCC(CC)CCCC
- CAS DataBase Reference
- 103 · 103-20-8(CAS DataBase Reference)
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
H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]
P273, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAquatic Chronic 4 (100%)
Safety data
- tsca
- TSCA listed
- hs_code
- 2905.19.9090
- Hazard statements
- H413
Chemistry & industry
Uses & manufacturing
General Manufacturing Information4-Undecanol, 7-ethyl-2-methyl-: ACTIVE
Applications
UsesIntermediate for synthetic lubricants, defoamers, and surfactants.
Upstream & downstream products
Downstream products
Suppliers51 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
广东云星生物技术有限公司
Related reactions
1 records
Compound notes
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