Pirimicarb - analytical standard, ≥99% , CAS No.23103-98-2

CAS: 23103-98-2 Cat. No.: P109830 Summenformel: C₁₁H₁₈N₄O₂ Molekulargewicht: 238.29 Beilstein Registry Number: 663442 EG-Nummer: 245-430-1

QUALITÄT & REINHEIT Analytical standard, ≥99%

Synonyms

NCGC00163704-02 | YFGYUFNIOHWBOB-UHFFFAOYSA- | DTXCID9012569 | Tox21_301003 | AI3-27766 | Pirimicarbe | Pirimicarb [ANSI:BSI:ISO] | Carbamic acid, dimethyl-, 2-(dimethylamino)-5,6-dimethyl-4-pyrimidinyl ester | NCGC00254905-01 | 2-(dimethylamino)-5,6-dime

Storage

Room temperature

Shipped In

Normal

Spezifikationen

Synonyme

NCGC00163704-02 | YFGYUFNIOHWBOB-UHFFFAOYSA- | DTXCID9012569 | Tox21_301003 | AI3-27766 | Pirimicarbe | Pirimicarb [ANSI:BSI:ISO] | Carbamic acid, dimethyl-, 2-(dimethylamino)-5,6-dimethyl-4-pyrimidinyl ester | NCGC00254905-01 | 2-(dimethylamino)-5,6-dime

Spezifikationen & Reinheit

analytical standard, ≥99%

Storage

Room temperature

Verschickt in

Normal

Note

Analytischer Standard

Aktionsart

INHIBITOR

Reinheit

≥99%

Namen und Kennungen

Pubchem Sid

508813566

Kanonisches Lächeln

CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C

IUPAC Name

[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate

InChIKey

YFGYUFNIOHWBOB-UHFFFAOYSA-N

INCHI

1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3

Isomere SMILES

CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C

WGK Deutschland

3

UN-Nummer

2811

Molekulargewicht

238.29

Beilstein

663442

Reaxy-Rn

663442

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=663442&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Klasse Organonitrogen compounds
      • Subclass Amines
        • Ebene5 Tertiary amines
          • Ebene6 Tertiary alkylarylamines
            • Ebene7 Dialkylarylamines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Klasse: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Tertiary amines - Tertiary alkylarylamines
• Direct Parent: Dialkylarylamines
• Alternative Parents: Aminopyrimidines and derivatives Heteroaromatic compounds Carbamate esters Organic carbonic acids and derivatives Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Dialkylarylamine - Aminopyrimidine - Pyrimidine - Heteroaromatic compound - Carbamic acid ester - Carbonic acid derivative - Azacycle - Organoheterocyclic compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aromatic heteromonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as dialkylarylamines. These are aliphatic aromatic amines in which the amino group is linked to two aliphatic chains and one aromatic group.
• External Descriptors: Carbamate insecticides

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

Zugehörige Ziele (menschlich)

ESR1 Tclin Estrogen receptor alpha (17718 Activities)

Discover Target: ESR1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

VDR Tclin Vitamin D receptor (26531 Activities)

Discover Target: VDR

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Löslichkeit: Slightly soluble in water, easily soluble in most organic solvents.
• Flammpunkt (°F): ＞212℉
• Flammpunkt (°C): ＞100℃
• Schmelzpunkt (°C): 90.5°C
• Molekulargewicht: 238.290 g/mol
• XLogP3: 1.700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 238.143 Da
• Monoisotopic Mass: 238.143 Da
• Topological Polar Surface Area: 58.600 Ų
• Heavy Atom Count: 17
• Formal Charge: 0
• Complexity: 270.000
• 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: 1