| CAS Number | 1094072-05-5 |
| Catalog Number | AG01BDFR(AGN-PC-0WOQCA) |
| Chemical Name | Tetrahydro-4-(methylamino)-2H-pyran-4-methanol |
| IUPAC Name | [4-(methylamino)oxan-4-yl]methanol |
| InChI | InChI=1S/C7H15NO2/c1-8-7(6-9)2-4-10-5-3-7/h8-9H,2-6H2,1H3 |
| InChI Key | YLEIOMUTHKGVET-UHFFFAOYSA-N |
| MDL Number | MFCD12826791 |
| Molecular Formula | C7H15NO2 |
| Molecular Weight | 145.1995 |
| SMILES | CNC1(CCOCC1)CO |
| Synonyms | [4-(methylamino)oxan-4-yl]methanol,
1094072-05-5,
tetrahydro-4-(methylamino)-2H-Pyran-4-methanol,
SCHEMBL420729,
ZINC38121379,
AKOS010285602,
MCULE-1617755077,
NE23127,
BS-12562,
DA-47911,
FT-0748713,
[4-(methylamino)tetrahydro-2H-pyran-4-yl]methanol,
Z1169060901,
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| Complexity | 99.8 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 145.11g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 145.202g/mol |
| Monoisotopic Mass | 145.11g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 41.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.7 |
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Certificate of Analysis
Lot Number