| CAS Number | 1537584-26-1 |
| Catalog Number | AG01C7Q9 |
| Chemical Name | [1-(difluoromethyl)-1H-pyrrol-2-yl]methanol |
| IUPAC Name | [1-(difluoromethyl)pyrrol-2-yl]methanol |
| InChI | InChI=1S/C6H7F2NO/c7-6(8)9-3-1-2-5(9)4-10/h1-3,6,10H,4H2 |
| InChI Key | QKIPTBWOZZIALC-UHFFFAOYSA-N |
| MDL Number | MFCD21768411 |
| Molecular Formula | C6H7F2NO |
| Molecular Weight | 147.1227 |
| SMILES | OCC1N(C(F)F)C=CC=1 |
| Synonyms | [1-(difluoromethyl)-1H-pyrrol-2-yl]methanol,
1537584-26-1,
AKOS015744944,
|
| Complexity | 110 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 147.05g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 147.125g/mol |
| Monoisotopic Mass | 147.05g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 25.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
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Lot Number