| CAS Number | 398487-56-4 |
| Catalog Number | AG01BDWG(AGN-PC-0WO7Z0) |
| Chemical Name | 2-(oxan-4-yloxy)ethan-1-ol |
| IUPAC Name | 2-(oxan-4-yloxy)ethanol |
| InChI | InChI=1S/C7H14O3/c8-3-6-10-7-1-4-9-5-2-7/h7-8H,1-6H2 |
| InChI Key | LZECSOMGRCGVFL-UHFFFAOYSA-N |
| MDL Number | MFCD16102822 |
| Molecular Formula | C7H14O3 |
| Molecular Weight | 146.1843 |
| SMILES | O1CCC(CC1)OCCO |
| Synonyms | 2-(oxan-4-yloxy)ethan-1-ol,
398487-56-4,
2-((Tetrahydro-2H-pyran-4-yl)oxy)ethan-1-ol,
SCHEMBL578882,
LZECSOMGRCGVFL-UHFFFAOYSA-N,
4-(2-hydroxyethoxy)tetrahydropyran,
2-(tetrahydropyran-4-yloxy)ethanol,
4-(2-hydroxyethoxy)-tetrahydropyran,
MFCD16102822,
ZINC44237459,
AKOS011070247,
NE43210,
2-(Tetrahydro-2H-pyran-4-yloxy)ethanol,
Ethanol, 2-[(tetrahydro-2H-pyran-4-yl)oxy]-,
A1-08639,
2-[(tetrahydro-2H-pyran-4-yl)oxy]Ethanol,
|
| Complexity | 78.9 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 146.094g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 146.186g/mol |
| Monoisotopic Mass | 146.094g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 38.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number