Cas no 50668-49-0 (3,6,9,12-Tetraoxatetradecan-1-ol,13-methyl-)
50668-49-0 structure
Product Name:3,6,9,12-Tetraoxatetradecan-1-ol,13-methyl-
CAS No:50668-49-0
MF:C11H24O5
MW:236.305264472961
CID:372576
PubChem ID:6452237
Update Time:2025-04-19
3,6,9,12-Tetraoxatetradecan-1-ol,13-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 3,6,9,12-Tetraoxatetradecan-1-ol,13-methyl-
- 13-Methyl-3,6,9,12-tetraoxatetradecan-1-ol
- 2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethanol
- SCHEMBL3876514
- 50668-49-0
- NS00032116
- EINECS 256-700-3
- DTXSID50198704
- 3,6,9,12-Tetraoxatetradecan-1-ol, 13-methyl-
- 86UW2Y5S67
- Tetraethylene glycol monoisopropyl ether
-
- Inchi： 1S/C11H24O5/c1-11(2)16-10-9-15-8-7-14-6-5-13-4-3-12/h11-12H,3-10H2,1-2H3
- InChI Key： JECPJHZWLKEQFB-UHFFFAOYSA-N
- SMILES： O(CCOCCOCCOCCO)C(C)C
Computed Properties
- Exact Mass: 236.16242
- Monoisotopic Mass: 236.162374
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 16
- Rotatable Bond Count: 12
- Complexity: 130
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 57.2
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: nothing
Experimental Properties
- Density: 1.012
- Boiling Point: 313.2°C at 760 mmHg
- Flash Point: 143.2°C
- Refractive Index: 1.439
- PSA: 57.15
3,6,9,12-Tetraoxatetradecan-1-ol,13-methyl- Related Literature
-
Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
-
Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
-
Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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