| CAS Number | 1354550-84-7 |
| Catalog Number | AG00AAPK(AGN-PC-0WBSXS) |
| Chemical Name | 3-(Prop-2-Yn-1-Yl)Oxetan-3-Ol |
| IUPAC Name | 3-prop-2-ynyloxetan-3-ol |
| InChI | InChI=1S/C6H8O2/c1-2-3-6(7)4-8-5-6/h1,7H,3-5H2 |
| InChI Key | NUVJUOZKDXUTIN-UHFFFAOYSA-N |
| MDL Number | MFCD20444450 |
| Molecular Formula | C6H8O2 |
| Molecular Weight | 112.1265 |
| SMILES | OC1(CC#C)COC1 |
| Synonyms | 3-(Prop-2-ynyl)oxetan-3-ol,
1354550-84-7,
3-(prop-2-yn-1-yl)oxetan-3-ol,
KS-000008AI,
3915AD,
MFCD20444450,
ZINC74938387,
AKOS016015635,
AS-53474,
CS-0051667,
C6H8O2,
|
| Complexity | 127 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 112.052g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 112.128g/mol |
| Monoisotopic Mass | 112.052g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.4 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number