| CAS Number | 1342404-07-2 |
| Catalog Number | AG019TPF(AGN-PC-0WOCWD) |
| Chemical Name | 1-(Oxolan-3-yl)ethan-1-ol |
| IUPAC Name | 1-(oxolan-3-yl)ethanol |
| InChI | InChI=1S/C6H12O2/c1-5(7)6-2-3-8-4-6/h5-7H,2-4H2,1H3 |
| InChI Key | ARDSHQRPKXPELC-UHFFFAOYSA-N |
| MDL Number | MFCD18366186 |
| Molecular Formula | C6H12O2 |
| Molecular Weight | 116.1583 |
| SMILES | CC(C1COCC1)O |
| Synonyms | 1-(oxolan-3-yl)ethan-1-ol,
1342404-07-2,
SCHEMBL12988554,
AKOS012872261,
MCULE-1059653145,
NE27380,
1-(oxolan-3-yl)ethan-1-ol, Mixture of diastereomers,
Z1342884095,
(1S)-1-(oxolan-3-yl)ethan-1-ol,
(1R)-1-(oxolan-3-yl)ethan-1-ol,
1372904-08-9,
1372908-76-3,
|
| Complexity | 72.9 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 116.084g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 116.16g/mol |
| Monoisotopic Mass | 116.084g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number