(S)-4-Carboxy-5,5-dimethylthiazolidine - CAS 22916-26-3
Catalog: |
BB070628 |
Product Name: |
(S)-4-Carboxy-5,5-dimethylthiazolidine |
CAS: |
22916-26-3 |
Synonyms: |
(4S)-5,5-Dimethyl-4-thiazolidinecarboxylic Acid; D-5,5-Dimethylthiazolidine-4-carboxylic Acid; d-5,5-Dimethylthiazolidine-4-carboxylic Acid |
IUPAC Name: | (4S)-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid |
Description: | (S)-4-Carboxy-5,5-dimethylthiazolidine is a Proline-Catalyst for Mannich reactions. |
Molecular Weight: | 161.22 |
Molecular Formula: | C6H11NO2S |
Canonical SMILES: | CC1(C(NCS1)C(=O)O)C |
InChI: | InChI=1S/C6H11NO2S/c1-6(2)4(5(8)9)7-3-10-6/h4,7H,3H2,1-2H3,(H,8,9)/t4-/m0/s1 |
InChI Key: | PMQQFSDIECYOQV-BYPYZUCNSA-N |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 158 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 161.05104977 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 161.05104977 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 74.6Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -1.7 |
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