| CAS Number | 1393688-82-8 |
| Catalog Number | AG001AVF(AGN-PC-0WNGY1) |
| Chemical Name | 3-Oxetanemethanol, 3-(difluoromethyl)- |
| IUPAC Name | [3-(difluoromethyl)oxetan-3-yl]methanol |
| InChI | InChI=1S/C5H8F2O2/c6-4(7)5(1-8)2-9-3-5/h4,8H,1-3H2 |
| InChI Key | QRAZUHUBNRHJHZ-UHFFFAOYSA-N |
| MDL Number | MFCD30166303 |
| Molecular Formula | C5H8F2O2 |
| Molecular Weight | 138.1126 |
| SMILES | OCC1(C(F)F)COC1 |
| Synonyms | [3-(difluoromethyl)oxetan-3-yl]methanol,
1393688-82-8,
SCHEMBL16572230,
KS-000006EH,
MFCD30166303,
SB22586,
AS-53878,
CS-0052997,
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| Complexity | 101 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 138.049g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 138.114g/mol |
| Monoisotopic Mass | 138.049g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.1 |
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Certificate of Analysis
Lot Number