(5S)-(−)-5-(Trifluoromethyl)-2-pyrrolidinone - CAS 1287211-10-2
Catalog: |
BB006925 |
Product Name: |
(5S)-(−)-5-(Trifluoromethyl)-2-pyrrolidinone |
CAS: |
1287211-10-2 |
Synonyms: |
(5S)-5-(trifluoromethyl)pyrrolidin-2-one |
IUPAC Name: | (5S)-5-(trifluoromethyl)pyrrolidin-2-one |
Description: | (5S)-(−)-5-(Trifluoromethyl)-2-pyrrolidinone (CAS# 1287211-10-2) is a useful research chemical. |
Molecular Weight: | 153.10 |
Molecular Formula: | C5H6F3NO |
Canonical SMILES: | C1CC(=O)NC1C(F)(F)F |
InChI: | InChI=1S/C5H6F3NO/c6-5(7,8)3-1-2-4(10)9-3/h3H,1-2H2,(H,9,10)/t3-/m0/s1 |
InChI Key: | BKONNPBZAYHNOV-VKHMYHEASA-N |
Storage: | Inert atmosphere, 2-8 °C |
MDL: | MFCD22566326 |
LogP: | 1.15610 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
EP-3670512-A1 | Diazabicyclooctanones as inhibitors of serine beta-lactamases | 20181218 |
CN-111107848-A | Pharmaceutical composition containing amide derivatives, and preparation method and application thereof | 20180810 |
WO-2020030107-A1 | Pharmaceutical composition containing amide derivatives, preparation method therefor, and application thereof | 20180810 |
EP-3608318-A1 | Diaazabicyclooctanone derivatives as antibacterials | 20180809 |
WO-2020030761-A1 | Diazabicyclooctanones as inhibitors of serine beta-lactamases | 20180809 |
Complexity: | 154 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 153.04014830 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 153.04014830 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 29.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.8 |
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