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(3S,4R)-3-ethyl-4-[(3-methylimidazol-4-yl)methyl]tetrahydrofuran-2-one hydrochloride

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Identification
Molecular formula
C11H17ClN2O2
CAS number
157340-29-9
IUPAC name
(3S,4R)-3-ethyl-4-[(3-methylimidazol-4-yl)methyl]tetrahydrofuran-2-one;hydrochloride
State
State

At room temperature, it exists typically as a solid.

Melting point (Celsius)
160.00
Melting point (Kelvin)
433.15
Boiling point (Celsius)
210.00
Boiling point (Kelvin)
483.15
General information
Molecular weight
230.72g/mol
Molar mass
230.7000g/mol
Density
1.2000g/cm3
Appearence

The compound typically appears as a crystalline solid. Its color can vary from white to off-white, depending on the level of purity and presence of impurities.

Comment on solubility

Solubility of (3S,4R)-3-ethyl-4-[(3-methylimidazol-4-yl)methyl]tetrahydrofuran-2-one; hydrochloride

The solubility of a compound can be influenced by various factors, including its structural characteristics and interactions with solvents. For the compound (3S,4R)-3-ethyl-4-[(3-methylimidazol-4-yl)methyl]tetrahydrofuran-2-one; hydrochloride (C11H17ClN2O2), we can observe several noteworthy aspects:

  • Hydrochloride Salt: The presence of the hydrochloride moiety typically enhances solubility in polar solvents such as water.
  • Amine Group Influence: The imidazole ring suggests potential for hydrogen bonding, likely increasing solvation.
  • Aliphatic Character: The ethyl group within the tetrahydrofuran enhances the molecule's hydrophobic character to a degree, which might complicate solubility in non-polar solvents.

In general, the combination of hydrophilic elements (like the ammonium ion from the hydrochloride) and hydrophobic elements (like the ethyl group) suggests that the solubility profile could be quite distinctive:

  1. Highly soluble in: Water and other polar solvents
  2. Poorly soluble in: Non-polar solvents

In conclusion, based on its structural components, it is expected that (3S,4R)-3-ethyl-4-[(3-methylimidazol-4-yl)methyl]tetrahydrofuran-2-one; hydrochloride exhibits good solubility in water with limited solubility in non-polar organic solvents. This characteristic is crucial for its applications in various chemical, pharmaceutical, and biomedical contexts.

Interesting facts

Interesting Facts about (3S,4R)-3-ethyl-4-[(3-methylimidazol-4-yl)methyl]tetrahydrofuran-2-one Hydrochloride

(3S,4R)-3-ethyl-4-[(3-methylimidazol-4-yl)methyl]tetrahydrofuran-2-one hydrochloride is a fascinating compound that belongs to a class of molecules known as tetrahydrofuran derivatives. This compound exhibits several intriguing characteristics that make it a subject of interest in both medicinal and synthetic chemistry.

Key Features

  • Chiral Centers: The presence of chiral centers at positions 3 and 4 indicates this compound can exist in two enantiomeric forms. Chiral molecules often exhibit different biological activities, making them particularly interesting in drug development.
  • Biological Relevance: Compounds with imidazole rings, such as the one in this molecule, are often found in biologically active molecules, including amino acids and various pharmaceuticals. Their interactions with biological systems can lead to significant therapeutic effects.
  • Synthetic Pathways: This compound can be synthesized using advanced organic synthesis techniques, which contribute to the development of new materials and drugs. Understanding its synthetic routes can provide valuable insights into optimizing yield and purity.

Applications

This compound may have potential applications in:

  • Pharmaceuticals, where its specific structural features could lead to new treatments.
  • Material science, where derivatives are explored for their unique properties.

Conclusion

In summary, (3S,4R)-3-ethyl-4-[(3-methylimidazol-4-yl)methyl]tetrahydrofuran-2-one hydrochloride is a compound of significance in the fields of synthetic and medicinal chemistry. Ongoing research into its properties and applications could unlock further potential in therapeutic advancements. As one might say in the scientific community, “The more we explore, the more we discover!”

Synonyms
Pilocarpine hydrochloride
54-71-7
(+)-Pilocarpine hydrochloride
Pilocarpine HCl
Almocarpine
Salagen
Pilocarpal
Pilocar SMP
Adsorbocarpine
Pilomiotin
Pilocar
Pilocel
Pilovisc
Epicar
Pilocarpine monohydrochloride
Sno pilo
Mistura P
Pilocarpine muriate
Isopto carpine
Isopto-carpine
MI-Pilo Ophth Sol
Vistacarpin N
Ami-pilo
Amistura P
PILOPINE HS
Pilocarpine, hydrochloride
Spersacarpine hydrochloride
Pilokarpin monohydrochloride
Pilopine
NSC 5746
VUITY
Pilocarpinum muriaticum
Pilocarpine chloride
Pilocarpine (Hydrochloride)
EINECS 200-212-5
PILOCARPINE, MONOHYDROCHLORIDE
UNII-0WW6D218XJ
Isoptocarpine
PILO
0WW6D218XJ
AI3-61859
NSC5746
Pilocarpini hydrochloridum
MLS000069454
DTXSID2041096
CHEBI:141029
(3S,4R)-3-ethyl-4-[(3-methylimidazol-4-yl)methyl]oxolan-2-one;hydrochloride
Pilocarpine hydrochloride [USP:JAN]
2(3H)-Furanone, 3-ethyldihydro-4-((1-methyl-1H-imidazol-5-yl)methyl)-, monohydrochloride, (3S,4R)-
2(3H)-Furanone, 3-ethyldihydro-4-((1-methyl-1H-imidazol-5-yl)methyl)-, monohydrochloride, (3S-cis)-
SMR000059053
(3S,4R)-3-ethyl-4-((1-methyl-1H-imidazol-5-yl)methyl)dihydrofuran-2(3H)-one hydrochloride
BETOPTIC PILO COMPONENT PILOCARPINE HYDROCHLORIDE
Hydrochloride, Pilocarpine
Sanpilo
Pilocarpine hydrochloride (USP:JAN)
Pilopine HS Gel
(3S,4R)-3-ethyl-4-[(1-methyl-1H-imidazol-5-yl)methyl]dihydrofuran-2(3H)-one hydrochloride
PILOCARPINE HYDROCHLORIDE (MART.)
PILOCARPINE HYDROCHLORIDE [MART.]
PILOCARPINE HYDROCHLORIDE (USP-RS)
PILOCARPINE HYDROCHLORIDE [USP-RS]
PILOCARPINE HYDROCHLORIDE (EP IMPURITY)
PILOCARPINE HYDROCHLORIDE (EP MONOGRAPH)
PILOCARPINE HYDROCHLORIDE (USP IMPURITY)
PILOCARPINE HYDROCHLORIDE [EP IMPURITY]
PILOCARPINE HYDROCHLORIDE [EP MONOGRAPH]
PILOCARPINE HYDROCHLORIDE [USP IMPURITY]
PILOCARPINE HYDROCHLORIDE (USP MONOGRAPH)
PILOCARPINE HYDROCHLORIDE [USP MONOGRAPH]
MFCD00012722
Pilocarpine hydrochlororide
pilocarpine-hcl
SR-01000000054
Mi-Pilo
component of Epicar
Salagen (TN)
Sanpilo (TN)
component of Pilocar
QLOSI
Pilopine HS (TN)
Isopto carpine (TN)
NSC-5746
pilocarpine hydrchloride
pilocarpine hyrochloride
regid855931
Opera_ID_1616
Pilocarpine, Monohydrochloride, (3S-cis)-Isomer
SCHEMBL41427
MLS000758210
MLS001076314
MLS001424017
PILOCARPINE HCL [VANDF]
CHEMBL1200330
DTXCID0021096
HY-B0726R
HY-B0726
Tox21_500950
s4231
PILOCARPINE HYDROCHLORIDE [MI]
PILOCARPINUM MURIATICUM [HPUS]
AKOS005267231
Pilocarpine hydrochloride (JP17/USP)
CCG-100757
FP27043
LP00950
Pilocarpine (Hydrochloride) (Standard)
PILOCARPINE HYDROCHLORIDE [JAN]
(3S,4R)-3-ethyl-4-[(1-methylimidazol-5-yl)methyl]-3,4,5-trihydrofuran-2-one, c hloride
NCGC00094254-01
NCGC00261635-01
PILOCARPINE HYDROCHLORIDE [VANDF]
(3S,4R)-4,5-Dihydro-3-ethyl-4-(1-methyl-1H-imidazol-5-ylmethyl)-2(3H)-furanone hydrochloride
AC-33119
PILOCARPINE HYDROCHLORIDE [WHO-DD]
PILOCARPINE HYDROCHLORIDE [WHO-IP]
EU-0100950
NS00076232
Pilocarpine Hydrochloride Ophthalmic Solution
SW196587-4
D02200
D91961
P 6503
PILOCARPINE HYDROCHLORIDE [ORANGE BOOK]
2(3H)-Furanone, monohydrochloride, (3S-cis)-
PILOCARPINI HYDROCHLORIDUM [WHO-IP LATIN]
WLN: T5OVTJ C2 D1- DT5N CNJ C1 &GH
SR-01000000054-3
SR-01000075339-1
Pilocarpine hydrochloride, >=98% (titration), powder
Q23059847
PILOCARPINE HYDROCHLORIDE COMPONENT OF BETOPTIC PILO
Pilocarpine hydrochloride, meets USP testing specifications
Pilocarpine hydrochloride, European Pharmacopoeia (EP) Reference Standard
(3S,4R)-3-ethyl-4-[(1-methyl-1H-imidazol-5-yl)methyl]oxolan-2-one hydrochloride
Pilocarpine Hydrochloride, Pharmaceutical Secondary Standard; Certified Reference Material
Pilocarpine hydrochloride, United States Pharmacopeia (USP) Reference Standard
(3S,4R)-3-Ethyl-4-(1-methyl-1H-imidazol-5-ylmethyl)-4,5-dihydrofuran-2(3H)-one monohydochloride
2(3H)-Furanone, 3-ethyldihydro-4-((1-methyl-1H-imidazol-5-yl)methyl)-, hydrochloride (1:1), (3S,4R)-
200-212-5