| CAS Number | 1801708-76-8 |
| Catalog Number | AG01AG27(AGN-PC-0WO4KN) |
| Chemical Name | (4,4-Difluoropyrrolidin-2-yl)methanol hydrochloride |
| IUPAC Name | (4,4-difluoropyrrolidin-2-yl)methanol;hydrochloride |
| InChI | InChI=1S/C5H9F2NO.ClH/c6-5(7)1-4(2-9)8-3-5;/h4,8-9H,1-3H2;1H |
| InChI Key | JWAVXSQHRZARDV-UHFFFAOYSA-N |
| MDL Number | MFCD27920313 |
| Molecular Formula | C5H10ClF2NO |
| Molecular Weight | 173.5888 |
| SMILES | Cl.OCC1NCC(F)(F)C1 |
| Synonyms | (4,4-difluoropyrrolidin-2-yl)methanol hydrochloride,
1801708-76-8,
SCHEMBL14911949,
AKOS026727578,
NE39043,
(R)-(4,4-difluoropyrrolidin-2-yl)methanol hydrochloride,
(S)-(4,4-Difluoropyrrolidin-2-yl)methanol hydrochloride,
1315593-71-5,
623583-10-8,
|
| Complexity | 107 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 173.042g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 173.588g/mol |
| Monoisotopic Mass | 173.042g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number