(2R,3S)-3-Amino-2-methyl-4-oxo-1-azetidinesulfonic Acid - CAS 80582-09-8
Catalog: |
BB074586 |
Product Name: |
(2R,3S)-3-Amino-2-methyl-4-oxo-1-azetidinesulfonic Acid |
CAS: |
80582-09-8 |
Synonyms: |
(2R,3S)-3-AMINO-2-METHYL-4-OXO-1-AZETIDINESULFONIC ACID; (2R,3S)-3-Amino-2-methyl-4-oxoazetidine-1-sulfonic acid; (3S-cis)-3-Amino-4-methyl-2-oxo-1-azetidinesulfonic acid |
IUPAC Name: | (2R,3S)-3-amino-2-methyl-4-oxoazetidine-1-sulfonic acid |
Molecular Weight: | 180.18 |
Molecular Formula: | C4H8N2O4S |
Canonical SMILES: | CC1C(C(=O)N1S(=O)(=O)O)N |
InChI: | InChI=1S/C4H8N2O4S/c1-2-3(5)4(7)6(2)11(8,9)10/h2-3H,5H2,1H3,(H,8,9,10)/t2-,3+/m1/s1 |
InChI Key: | ISUIVWNWEDIHJD-GBXIJSLDSA-N |
Melting Point: | 206-211°C |
Solubility: | Water |
Appearance: | White Solid |
Storage: | -20°C |
Complexity: | 279 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 2 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 180.02047791 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 180.02047791 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 109Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -3.6 |
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