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62400-75-3 | 5-Hydroxymethyl-pyrrolidine-2-one
CAS No: 62400-75-3 Catalog No: AG0039X9 MDL No:MFCD06661931
Product Description
Catalog Number:
AG0039X9
Chemical Name:
5-Hydroxymethyl-pyrrolidine-2-one
CAS Number:
62400-75-3
Molecular Formula:
C5H9NO2
Molecular Weight:
115.1305
MDL Number:
MFCD06661931
IUPAC Name:
5-(hydroxymethyl)pyrrolidin-2-one
InChI:
InChI=1S/C5H9NO2/c7-3-4-1-2-5(8)6-4/h4,7H,1-3H2,(H,6,8)
InChI Key:
HOBJEFOCIRXQKH-UHFFFAOYSA-N
SMILES:
OCC1CCC(=O)N1
Properties
Complexity:
103
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
115.063g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
115.132g/mol
Monoisotopic Mass:
115.063g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-1
Literature
| Title | Journal |
|---|---|
| Human volunteer study on the inhalational and dermal absorption of N-methyl-2-pyrrolidone (NMP) from the vapour phase. | Archives of toxicology 20080101 |
| Human experimental exposure study on the uptake and urinary elimination of N-methyl-2-pyrrolidone (NMP) during simulated workplace conditions. | Archives of toxicology 20070501 |
| Human volunteer study on the influence of exposure duration and dilution of dermally applied N-methyl-2-pyrrolidone (NMP) on the urinary elimination of NMP metabolites. | International archives of occupational and environmental health 20070201 |
| Comparative developmental toxicities of the three major metabolites of N-methyl-2-pyrrolidone after oral administration in rats. | Journal of applied toxicology : JAT 20070101 |
| Ambient monitoring and biomonitoring of workers exposed to N-methyl-2-pyrrolidone in an industrial facility. | International archives of occupational and environmental health 20060501 |
| Enantioselective synthesis and preliminary pharmacological evaluation of the enantiomers of unifiram (DM232), a potent cognition-enhancing agent. | Medicinal chemistry (Shariqah (United Arab Emirates)) 20050901 |
| Evaluation of exposure biomarkers from percutaneous absorption of N-methyl-2-pyrrolidone. | Scandinavian journal of work, environment & health 20040801 |
| Human experimental exposure to N-methyl-2-pyrrolidone (NMP): toxicokinetics of NMP, 5-hydroxy- N-methyl-2-pyrrolidone, N-methylsuccinimide and 2-hydroxy- N-methylsuccinimide (2-HMSI), and biological monitoring using 2-HMSI as a biomarker. | International archives of occupational and environmental health 20030501 |
| Determination of 5-hydroxy-N-methyl-2-pyrrolidone and 2-hydroxy-N-methylsuccinimide in human plasma and urine using liquid chromatography-electrospray tandem mass spectrometry. | Journal of chromatography. B, Biomedical sciences and applications 20010915 |
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