Methyl acetimidate hydrochloride - ≥97% , CAS No.14777-27-6

CAS: 14777-27-6 Cat. No.: M167386 Summenformel: CH₃C(=NH)OCH₃·HCl Molekulargewicht: 109.55 Beilstein Registry Number: 3671580 EG-Nummer: 238-843-3

QUALITÄT & REINHEIT ≥97%

Synonyms

ACETIMIDIC ACID, METHYL ESTER, HYDROCHLORIDE | BP-10648 | Methyl acetimidate hydrochloride | SCHEMBL2266274 | MFCD00012571 | Q27236117 | Methyl acetimidate hydrochloride, technical grade | DTXSID80884769 | FT-0621766 | Methyl acetimidate, HCl | Methyl ace

Storage

Store at 2-8°C

Shipped In

Wet ice

Übersicht

Methyl acetimidate hydrochloride is an inhibitor of N-methylation of phosphatidylethanolamine. It also prevents the stimulation of purified cardiac sarcolemmal vesicles Ca2+-pump activities.

Application：

Methyl acetimidate hydrochloride has been used in pre-crystallization chemical modification of lysine residues.

Spezifikationen

Synonyme

ACETIMIDIC ACID, METHYL ESTER, HYDROCHLORIDE | BP-10648 | Methyl acetimidate hydrochloride | SCHEMBL2266274 | MFCD00012571 | Q27236117 | Methyl acetimidate hydrochloride, technical grade | DTXSID80884769 | FT-0621766 | Methyl acetimidate, HCl | Methyl ace

Spezifikationen & Reinheit

≥97%

Storage

Store at 2-8°C

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥97%

Namen und Kennungen

Pubchem Sid

528773457

Kanonisches Lächeln

CC(=N)OC.Cl

IUPAC Name

methyl ethanimidate;hydrochloride

InChIKey

WHYJXXISOUGFLJ-UHFFFAOYSA-N

INCHI

1S/C3H7NO.ClH/c1-3(4)5-2;/h4H,1-2H3;1H

Isomere SMILES

CC(=N)OC.Cl

WGK Deutschland

3

RTECS

AK2950000

Molekulargewicht

109.55

Beilstein

3671580

Reaxy-Rn

3671581

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3671581&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Klasse Carboximidic acids and derivatives
      • Subclass Imidoesters

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Klasse: Carboximidic acids and derivatives
• Subclass: Imidoesters
• Intermediate Tree Nodes: Not available
• Direct Parent: Imidoesters
• Alternative Parents: Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic chloride salts Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Imido ester - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organic chloride salt - Organic salt - Organooxygen compound - Organonitrogen compound - Aliphatic acyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as imidoesters. These are organic ester derivatives of imidic acid. They have the general structure ROC(CR')=NR\", where R=organyl group, R'-R\"= H or organyl group.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemische und physikalische Eigenschaften

• Schmelzpunkt (°C): 105 °C (dec.) (lit.)
• Molekulargewicht: 109.550 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 109.029 Da
• Monoisotopic Mass: 109.029 Da
• Topological Polar Surface Area: 33.100 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 42.200
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

XLogP3