94681

Methyl 3,5-dinitrobenzoate

Standard for quantitative NMR, TraceCERT®, Manufactured by: Sigma-Aldrich Production GmbH, Switzerland

Manufacturer: Supelco

CAS Number: 2702-58-1

Synonym(S): 3,5-Dinitrobenzoic acid methyl ester, NSC 7317

Select a Size

Pack Size SKU Availability Price
1 G 94681-1-G In Stock ₹ 16,010.18

94681 - 1 G

₹ 16,010.18

In Stock

Quantity

1

Base Price: ₹ 16,010.18

GST (18%): ₹ 2,881.832

Total Price: ₹ 18,892.012

grade

Standard for quantitative NMRTraceCERT®

Quality Level

300

form

powder

shelf life

limited shelf life, expiry date on the label

manufacturer/tradename

Manufactured by: Sigma-Aldrich Production GmbH, Switzerland

technique(s)

qNMR: suitable

mp

107-109 °C (lit.)

application(s)

cleaning productscosmeticsflavors and fragrancesfood and beveragespersonal carepharmaceutical

SMILES string

COC(=O)c1cc(cc(c1)[N+]([O-])=O)[N+]([O-])=O

InChI

1S/C8H6N2O6/c1-16-8(11)5-2-6(9(12)13)4-7(3-5)10(14)15/h2-4H,1H3

Other Options

Image Product Name Manufacturer Price Range
11-100-2207
TraceCERT™ Methyl 3,5-dinitrobenzoate Standard for quantitative NMR, MilliporeSigma™ Supelco™
MilliporeSigma Supelco ₹ 20,277.72
386367
Methyl 3,5-dinitrobenzoate
Sigma Aldrich ₹ 10,260.00

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Description

  • 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)
  • Application: Antifungal activity against Candida albicans of methyl 3,5-dinitrobenzoate loaded nanoemulsion: This study explores the application of methyl 3,5-dinitrobenzoate within nanoemulsions, showing promising antifungal activity against Candida albicans, highlighting its potential in developing advanced pharmaceutical formulations and research chemicals for antifungal therapies (Duarte et al., 2024).
  • Recommended products: Find a digital Reference Material for this product available on our online platform ChemisTwin® for NMR. You can use this digital equivalent on ChemisTwin® for your sample identity confirmation and compound quantification (with digital external standard). An NMR spectrum of this substance can be viewed and an online comparison against your sample can be performed with a few mouseclicks. Learn more here and start your free trial.
  • Legal Information: TraceCERT is a registered trademark of Merck KGaA, Darmstadt, Germany

SAFETY INFORMATION

Pictograms

GHS07

Signal Word

Warning

Hazard Statements

H302

Precautionary Statements

P264 - P270 - P301 + P312 - P501

Hazard Classifications

Acute Tox. 4 Oral

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

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Standard for quantitative NMRTraceCERT®

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form:
powder

shelf life:
limited shelf life, expiry date on the label

manufacturer/tradename:
Manufactured by: Sigma-Aldrich Production GmbH, Switzerland

technique(s):
qNMR: suitable

mp:
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cleaning productscosmeticsflavors and fragrancesfood and beveragespersonal carepharmaceutical

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COC(=O)c1cc(cc(c1)[N+]([O-])=O)[N+]([O-])=O

InChI:
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SMILES string:
O=C(C([C@@]1(O)[C@H](C)CC[C@](C[C@H](OC)/C(C)=C/C=C/C=C/[C@@H](C)C[C@@H](C)C2=O)([H])O1)=O)N3[C@H](C(O[C@@]([C@@H](C[C@@]4([H])C[C@@H](OC)[C@H](OCCO)CC4)C)([H])CC([C@H](C)/C=C(C)/[C@@H](O)[C@H]2OC)=O)=O)CCCC3

InChI:
1S/C53H83NO14/c1-32-16-12-11-13-17-33(2)44(63-8)30-40-21-19-38(7)53(62,68-40)50(59)51(60)54-23-15-14-18-41(54)52(61)67-45(35(4)28-39-20-22-43(66-25-24-55)46(29-39)64-9)31-42(56)34(3)27-37(6)48(58)49(65-10)47(57)36(5)26-32/h11-13,16-17,27,32,34-36,38-41,43-46,48-49,55,58,62H,14-15,18-26,28-31H2,1-10H3/b13-11+,16-12+,33-17+,37-27+/t32-,34-,35-,36-,38-,39+,40+,41+,43-,44+,45+,46-,48-,49+,53-/m1/s1

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grade:
certified reference materialTraceCERT®

Quality Level:
300

form:
__

shelf life:
limited shelf life, expiry date on the label

manufacturer/tradename:
Manufactured by: Sigma-Aldrich Production GmbH, Switzerland

technique(s):
__

mp:
__

application(s):
__

SMILES string:
__

InChI:
__