Duranest
Basic information
- CAS
36637-19-1- Standard SMILES
CCC[NH+](CC)C(CC)C(=O)Nc1c(C)cccc1C.[Cl-]- InChIKey
LMWQQUMMGGIGJQ-UHFFFAOYSA-N- Molecular formula
- C17H29ClN2O
- Average molar mass
- 312.9 g/mol
- Monoisotopic mass
- 312.1968412
Overview
See also: Etidocaine Hydrochloride (preferred); Etidocaine (has active moiety); Epinephrine; etidocaine hydrochloride (component of) ... View More ...
Names & identifiers
- Preferred name
- Duranest
- IUPAC
- [1-(2,6-dimethylanilino)-1-oxobutan-2-yl]-ethyl-propylazanium chloride
- English name
- (±)-N-(2,6-dimethylphenyl)-2-(ethylpropylamino)butyramide monohydrochloride
- Molecular formula
- C17H29ClN2O
- Molecular weight
- 312.87796
Names & synonyms
Duranest[1-(2,6-dimethylanilino)-1-oxobutan-2-yl]-ethyl-propylazanium;chlorideEINECS 253-144-3UNII-G6N3B3U8E6(+-)-2-(N-Ethylpropylamino)-2',6'-butyroxylidide hydrochloride(1)-N-(2,6-Dimethylphenyl)-2-(ethylpropylamino)butyramide monohydrochloride2',6'-BUTYROXYLIDIDE, 2-(N-ETHYLPROPYLAMINO)-, HYDROCHLORIDE, (+-)-Butanamide, N-(2,6-dimethylphenyl)-2-(ethylpropylamino)-, monohydrochloride, (+-)-Duranest HydrochlorideEtidocaine HydrochlorideEtidocaine Hydrochloride, 10 mM in DMSON-(2,6-diMethylphenyl)-2-(ethylpropylaMino)butanaMide Hydrochloride
Show more names
inhibit,Etidocaine Hydrochloride,Etidocaine,EDC,Inhibitor,anesthetics()-N-(2,6-dimethylphenyl)-2-(ethylpropylamino)butyramide monohydrochloride(±)-N-(2,6-dimethylphenyl)-2-(ethylpropylamino)butyramide monohydrochloride(±)-N-(2,6-dimethylphenyl)-2-(ethylpropylamino)butyramide monohydrochloride(±)-N-(2,6-diMethylphenyl)-2-(ethylpropylaMino)butanaMide MonohydrochlorideButanaMide, N-(2,6-diMethylphenyl)-2-(ethylpropylaMino)-, Monohydrochloride
Properties
Computed structural properties
- Topological polar surface area
- 33.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 283
Physicochemical properties
- Melting point
- 203 · 203-203.5°
- storage temp.
- Hygroscopic, Refrigerator, under inert atmosphere
- solubility
- DMSO, Methanol
- form
- Solid
- color
- White to Off-White
- Stability
- Hygroscopic
- FDA UNII
- 6 N3B3U8E6 · G6N3B3U8E6
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Warning
- Hazard statements
- 301 · H301
- Precautionary statements
- 264 · P264-P270-P301+P310-P321-P330-P405-P501
- Toxicity
- 50 in · LD50 in female mice (mg/kg): 6.7 i.v.; 99 s.c. (Adams, 1972)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Toxicity
- LD50 in female mice (mg/kg): 6.7 i.v.; 99 s.c. (Adams, 1972)
- Signal word
- Warning
- Symbol(GHS)
- GHS06
- Hazard statements
- H301
- Precautionary statements
- P264-P270-P301+P310-P321-P330-P405-P501
Chemistry & industry
Applications
UsesEtidocaine Hydrochloride is a local anesthetic amide used during surgical procedures and during labor in pregnancies.
Upstream & downstream products
Upstream raw materials
Additional notes
DefinitionChEBI: Etidocaine hydrochloride is an amino acid amide.
Suppliers
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Related reactions
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Compound notes
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