Hexadecyl ethyleneglycol monoether
PubChem CID: 16492
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| Compound Synonyms | 2-(Hexadecyloxy)ethanol, 2136-71-2, Ethylene glycol monohexadecyl ether, 2-Hexadecoxyethanol, 2-Hexadecyloxyethanol, Hexadecyl ethyleneglycol monoether, Ethanol, 2-(hexadecyloxy)-, 69364-63-2, Ceteth-1, 2-(Hexadecyloxy)ethan-1-ol, 1-(2-Hydroxyethoxy)hexadecane, UO15AM5953, UNII-UO15AM5953, DTXSID00858846, ETHYLENE GLYCOL CETYL ETHER, EINECS 218-373-5, POLYOXYETHYLENE 20 ISOHEXADECYL ETHER, Hexadecylglycol, 2-(Hexadecyloxy)ethanol, 1-(2-Hydroxyethoxy)hexadecane, 2-Hexadecoxyethanol, Ethylene Glycol Monohexadecyl Ether, 1-O-Hexadecylglycol, C16E1, Hexadecylglycol, 2-(Hexadecyloxy) ethanol, CETETH-1 [INCI], SCHEMBL185805, DTXCID00809590, C16E1, MFCD00043350, FP-0099, HY-W250466, BP-29852, FH172143, CS-0312254, NS00006268, E82671, Q27291163, Ethylene glycol monohexadecyl ether, BioXtra, >=99.0% (TLC), 218-373-5 |
|---|---|
| Ghose Rule | True |
| Classyfire Kingdom | Organic compounds |
| Topological Polar Surface Area | 29.5 |
| Hydrogen Bond Donor Count | 1.0 |
| Pfizer 3 75 Rule | False |
| Np Classifier Class | Monoacylglycerols |
| Deep Smiles | CCCCCCCCCCCCCCCCOCCO |
| Heavy Atom Count | 20.0 |
| Classyfire Class | Organooxygen compounds |
| Classyfire Subclass | Ethers |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 159.0 |
| Database Name | imppat_phytochem;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 2-hexadecoxyethanol |
| Veber Rule | False |
| Classyfire Superclass | Organic oxygen compounds |
| Xlogp | 7.3 |
| Gsk 4 400 Rule | False |
| Molecular Formula | C18H38O2 |
| Inchi Key | FSAMVJAGJWGWTQ-UHFFFAOYSA-N |
| Silicos It Class | Poorly soluble |
| Rotatable Bond Count | 17.0 |
| Synonyms | 2-hexadecoxyethanol |
| Esol Class | Moderately soluble |
| Functional Groups | CO, COC |
| Compound Name | Hexadecyl ethyleneglycol monoether |
| Exact Mass | 286.287 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 286.287 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 286.5 |
| Gi Absorption | True |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Lipinski Rule Of 5 | True |
| Inchi | InChI=1S/C18H38O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-20-18-16-19/h19H,2-18H2,1H3 |
| Smiles | CCCCCCCCCCCCCCCCOCCO |
| Np Classifier Biosynthetic Pathway | Fatty acids |
| Defined Bond Stereocenter Count | 0.0 |
| Egan Rule | True |
| Np Classifier Superclass | Glycerolipids |
- 1. Outgoing r'ship
FOUND_INto/from Rhizophora Apiculata (Plant) Rel Props:Reference:https://doi.org/10.1080/0972060x.2014.909748 - 2. Outgoing r'ship
FOUND_INto/from Rhizophora Mucronata (Plant) Rel Props:Reference:https://doi.org/10.1080/0972060x.2014.909748