| CAS Number | 1212285-89-6 |
| Catalog Number | AG01C4IZ(AGN-PC-0WD8JD) |
| Chemical Name | trans-4-methoxytetrahydrofuran-3-amine |
| IUPAC Name | (3S,4R)-4-methoxyoxolan-3-amine |
| InChI | InChI=1S/C5H11NO2/c1-7-5-3-8-2-4(5)6/h4-5H,2-3,6H2,1H3/t4-,5-/m0/s1 |
| InChI Key | NMZQNYFRBOGYLM-WHFBIAKZSA-N |
| MDL Number | MFCD28501435 |
| Molecular Formula | C5H11NO2 |
| Molecular Weight | 117.1463 |
| SMILES | CO[C@H]1[C@H](N)COC1 |
| Synonyms | trans-4-Methoxytetrahydrofuran-3-amine,
SCHEMBL17924277,
1212285-89-6,
1609430-37-6,
ZINC21953277,
FS-6640,
(3S,4R)-4-Methoxytetrahydrofuran-3-amine,
CS-0046583,
rac-(3S,4R)-4-methoxytetrahydro-3-furanamine,
Y-6747,
3-furanamine,tetrahydro-4-methoxy-,(3r,4r)-rel-,
[(3S,4R)-4-methoxytetrahydro-3-furanyl]amine hydrochloride,
|
| Complexity | 76.8 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 117.078979g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 117.15g/mol |
| Monoisotopic Mass | 117.078979g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 44.5Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number