| CAS Number | 1416402-99-7 |
| Catalog Number | AG001GRM(AGN-PC-0WD087) |
| Chemical Name | 2H-Pyran-4-acetic acid, α-aminotetrahydro-, hydrochloride (1:1), (αR)- |
| IUPAC Name | (2R)-2-amino-2-(oxan-4-yl)acetic acid;hydrochloride |
| InChI | InChI=1S/C7H13NO3.ClH/c8-6(7(9)10)5-1-3-11-4-2-5;/h5-6H,1-4,8H2,(H,9,10);1H/t6-;/m1./s1 |
| InChI Key | KHYXIPVLUOQKMK-FYZOBXCZSA-N |
| MDL Number | MFCD18711390 |
| Molecular Formula | C7H14ClNO3 |
| Molecular Weight | 195.6440 |
| SMILES | Cl.N[C@@H](C(=O)O)C1CCOCC1 |
| Synonyms | D-4'-Tetrahydropyranylglycine HCl,
(R)-2-Amino-2-(tetrahydro-2H-pyran-4-yl)acetic acid hydrochloride,
1416402-99-7,
MFCD18711390,
AX8218769,
D-4'-Tetrahydropyranylglycine hydrochloride,
A-2556,
2H-Pyran-4-acetic acid, alpha-aminotetrahydro-, hydrochloride (1:1), (alphaR)-,
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| Complexity | 143 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 195.066g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 195.643g/mol |
| Monoisotopic Mass | 195.066g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 72.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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