Dimethylglyoxime(DMG) - ACS , CAS No.95-45-4

CAS: 95-45-4 Cat. No.: D111834 Summenformel: C₄H₈N₂O₂ Molekulargewicht: 116.12 Beilstein Registry Number: 506731 EG-Nummer: 202-420-1

GRADE & PURITY ACS

Synonyms

DMG | dimethylglyoxim | DTXCID0024393 | CAS-95-45-4 | EN300-21562 | HY-W012898 | 2971MFT1KY | Biacetyl dioxime | Dimethylglyoxime [MI] | (NE)-N-[(3E)-3-hydroxyiminobutan-2-ylidene]hydroxylamine | MFCD00002117 | Dimethylglyoxime | Diacetyl Dioxime | Dimeth

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyme

DMG | dimethylglyoxim | DTXCID0024393 | CAS-95-45-4 | EN300-21562 | HY-W012898 | 2971MFT1KY | Biacetyl dioxime | Dimethylglyoxime [MI] | (NE)-N-[(3E)-3-hydroxyiminobutan-2-ylidene]hydroxylamine | MFCD00002117 | Dimethylglyoxime | Diacetyl Dioxime | Dimeth

Spezifikationen & Reinheit

ACS

Storage

Room temperature

Verschickt in

Normal

Note

ACS

Namen und Kennungen

Pubchem Sid

504773252

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504773252

Kanonisches Lächeln

CC(=NO)C(=NO)C

IUPAC Name

(NE)-N-[(3E)-3-hydroxyiminobutan-2-ylidene]hydroxylamine

InChIKey

JGUQDUKBUKFFRO-GGWOSOGESA-N

INCHI

1S/C4H8N2O2/c1-3(5-7)4(2)6-8/h7-8H,1-2H3/b5-3+,6-4+

Isomere SMILES

C/C(=N\O)/C(=N/O)/C

WGK Deutschland

3

RTECS

EK2975000

UN-Nummer

2926

Verpackungsgruppe

III

Molekulargewicht

116.12

Beilstein

506731

Reaxy-Rn

506731

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=506731&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Klasse Organonitrogen compounds
      • Subclass Oximes

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Klasse: Organonitrogen compounds
• Subclass: Oximes
• Intermediate Tree Nodes: Not available
• Direct Parent: Ketoximes
• Alternative Parents: Organopnictogen compounds Organic oxygen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Ketoxime - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Aliphatic acyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as ketoximes. These are organic compounds with the general formula RC(R')=NOH (R,R' = organyl).
• 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

• Löslichkeit: Soluble in alcohol, acetone, ether
• Empfindlichkeit: Moisture sensitive.
• Schmelzpunkt (°C): 238-240°C
• Molekulargewicht: 116.120 g/mol
• XLogP3: 0.100
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 116.059 Da
• Monoisotopic Mass: 116.059 Da
• Topological Polar Surface Area: 65.200 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 112.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 2
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 2
• Covalently-Bonded Unit Count: 1