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06185

Benzoesäure

TraceCERT®, certified reference material, 1H-qNMR Standard, Manufactured by: Sigma-Aldrich Production GmbH, Switzerland

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PackungsgrößeSKUVerfügbarkeitPreis
1 g
Warenkorb auf Verfügbarkeit prüfen
€ 148,00

Über diesen Artikel

Lineare Formel:
C6H5COOH
CAS-Nummer:
Molekulargewicht:
122.12
NACRES:
NA.24
E Number:
E210
PubChem Substance ID:
UNSPSC Code:
41116107
EC Number:
200-618-2
MDL number:
Beilstein/REAXYS Number:
636131

€ 148,00


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Quality Segment

vapor density

4.21 (vs air)

vapor pressure

10 mmHg ( 132 °C)

description

qNMR Standard for organic solvents (8.2-7.4 ppm)

grade

certified reference material, TraceCERT®

form

crystalline

autoignition temp.

1061 °F

shelf life

limited shelf life, expiry date on the label

manufacturer/tradename

Manufactured by: Sigma-Aldrich Production GmbH, Switzerland

technique(s)

gas chromatography (GC): suitable, qNMR: suitable ((standard)), qNMR: suitable

bp

249 °C (lit.)

mp

121-125 °C (lit.)

application(s)

cleaning products
cosmetics
flavors and fragrances
food and beverages
personal care
pharmaceutical

format

neat

SMILES string

OC(=O)c1ccccc1

InChI

1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)

InChI key

WPYMKLBDIGXBTP-UHFFFAOYSA-N

General description

This certified reference material (CRM) is produced and certified in accordance with ISO/IEC 17025 and ISO 17034. This CRM is traceable to primary material from an NMI, e.g. NIST or NMIJ.
Certified content by quantitative NMR incl. uncertainty and expiry date are given on the certificate.
Download your certificate at: http://www.sigma-aldrich.com.

Check out our entire range of quantitative NMR standards (qNMR standards)
This substance is listed on the positive list of the EU regulation 10/2011 for plastics intended to come into contact with food. Find all available reference materials for compounds listed in 10/2011 here

Other Notes

Chemische Verschiebung: 7.4 - 8.2 ppm (Chemische Verschiebungen können in Abhängigkeit von den experimentellen Bedingungen leicht variieren)
Geeignete NMR-Lösungsmittel: MeOD, DMSO-d6
Check out ChemisTwin, our brand new online portal for identity confirmation of NMR spectra. A feature for quantitative NMR is in development. Learn more or reach out to us for a free trial.

Legal Information

TraceCERT is a registered trademark of Merck KGaA, Darmstadt, Germany

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Dieser Artikel
PHR1050W213128W213101
technique(s)

gas chromatography (GC): suitable, qNMR: suitable, qNMR: suitable ((standard))

technique(s)

HPLC: suitable, gas chromatography (GC): suitable

technique(s)

-

technique(s)

-

application(s)

cleaning products
cosmetics
flavors and fragrances
food and beverages
personal care
pharmaceutical

application(s)

cleaning products
cosmetics
food and beverages
personal care
pharmaceutical (small molecule)

application(s)

flavors and fragrances

application(s)

flavors and fragrances

format

neat

format

neat

format

-

format

-

grade

certified reference material, TraceCERT®

grade

certified reference material, pharmaceutical secondary standard

grade

FG, Fragrance grade, Halal, Kosher, natural

grade

FG, Halal, Kosher

vapor pressure

10 mmHg ( 132 °C)

vapor pressure

10 mmHg ( 132 °C)

vapor pressure

10 mmHg ( 132 °C)

vapor pressure

10 mmHg ( 132 °C)

manufacturer/tradename

Manufactured by: Sigma-Aldrich Production GmbH, Switzerland

manufacturer/tradename

-

manufacturer/tradename

-

manufacturer/tradename

-


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pictograms

Health hazardCorrosion

signalword

Danger

Hazard Classifications

Eye Dam. 1 - Skin Irrit. 2 - STOT RE 1 Inhalation

target_organs

Lungs

Lagerklasse

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

flash_point_f

Not applicable

flash_point_c

Not applicable



Analysenzertifikate (COA)

Suchen Sie nach Analysenzertifikate (COA), indem Sie die Lot-/Chargennummer des Produkts eingeben. Lot- und Chargennummern sind auf dem Produktetikett hinter den Wörtern ‘Lot’ oder ‘Batch’ (Lot oder Charge) zu finden.

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Artikel

Erfahren Sie mehr über das ChemisTwin®-Portal, das Online-Analysetool zur Interpretation von Spektren. Entdecken Sie die Vorteile für Ihr NMR-Labor, die Workflow-Integration und die Benutzerrollen. Erfahren Sie mehr über die digitalen Referenzmaterialien (dRM), die Algorithmusgenauigkeit, die unterstützten Datenformate, Abonnementformate und andere Themen.

The signal ratio of two different protons can be measured with tremendous precision, which enables the generation of certified reference materials for use as qNMR standards.

NMR shift charts assist in identifying impurities in deuterated solvents, aiding accurate chemical analysis.

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Verwandter Inhalt

ChemisTwin™ automates NMR result interpretation, saving time with structure confirmation and quantitative NMR measurements using electronic Reference Materials.

ChemisTwin™ automatisiert die Interpretation von NMR-Ergebnissen und spart Zeit bei der Strukturbestätigung und bei quantitativen NMR-Messungen mit elektronischen Referenzmaterialien.


Allen J Duplantier et al.
Journal of medicinal chemistry, 52(11), 3576-3585 (2009-05-15)
3-Hydroxyquinolin-2(1H)-one (2) was discovered by high throughput screening in a functional assay to be a potent inhibitor of human DAAO, and its binding affinity was confirmed in a Biacore assay. Cocrystallization of 2 with the human DAAO enzyme defined the
Copper-mediated C-H/C-H biaryl coupling of benzoic acid derivatives and 1,3-azoles.
Mayuko Nishino et al.
Angewandte Chemie (International ed. in English), 52(16), 4457-4461 (2013-03-21)
Wanchun Xiang et al.
ChemSusChem, 6(2), 256-260 (2013-01-25)
Sensing the sun: Incorporation of a cyanomethyl benzoic acid electron acceptor into donor-π-acceptor sensitizers for dye-sensitized-solar cell is shown to lead to devices with improved conversion efficiency when compared with more widely used cyanoacetic acid acceptor.



Global Trade Item Number

SKUGTIN
06185-1G04061838645890

Questions

1–2 of 2 Questions  
  1. How can I determine the shelf life / expiration / retest date of this product?

    1 answer
    1. If this product has an expiration or retest date, it will be shown on the Certificate of Analysis (COA, CofA). If there is no retest or expiration date listed on the product's COA, we do not have suitable stability data to determine a shelf life. For these products, the only date on the COA will be the release date; a retest, expiration, or use-by-date will not be displayed.
      For all products, we recommend handling per defined conditions as printed in our product literature and website product descriptions. We recommend that products should be routinely inspected by customers to ensure they perform as expected.
      For products without retest or expiration dates, our standard warranty of 1 year from the date of shipment is applicable.
      For more information, please refer to the Product Dating Information document: https://www.sigmaaldrich.com/deepweb/assets/sigmaaldrich/marketing/global/documents/418/501/product-dating-information-06-25-mk.pdf

      Helpful?

  2. How is shipping temperature determined? And how is it related to the product storage temperature?

    1 answer
    1. Products may be shipped at a different temperature than the recommended long-term storage temperature. If the product quality is sensitive to short-term exposure to conditions other than the recommended long-term storage, it will be shipped on wet or dry-ice. If the product quality is NOT affected by short-term exposure to conditions other than the recommended long-term storage, it will be shipped at ambient temperature. As shipping routes are configured for minimum transit times, shipping at ambient temperature helps control shipping costs for our customers. For more information, please refer to the Storage and Transport Conditions document: https://www.sigmaaldrich.com/deepweb/assets/sigmaaldrich/marketing/global/documents/316/622/storage-transport-conditions-mk.pdf

      Helpful?

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