Benzoic acid-d - ≥98 atom% D,≥98% , CAS No.406679-59-2

CAS: 406679-59-2 Cat. No.: B472011 Summenformel: C6H5CO2D Molekulargewicht: 123.13 EG-Nummer: 690-600-4
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GRADE & PURITY ≥98 atom% D,≥98%
Synonyms
Benzoic acid-d | deuterio benzoate
Storage
Room temperature
Size
Deutschland (EU)
USA*
Price
Qty
1g
B472011-1g
1 Auf Lager
138,75€
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Why this grade

≥98 atom% D,≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature Ships Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyme
Benzoic acid-d | deuterio benzoate
Spezifikationen & Reinheit
≥98 atom% D,≥98%
Storage
Room temperature
Reinheit
≥98 atom% D,≥98%
Namen und Kennungen
Pubchem Sid528775336
Kanonisches LächelnC1=CC=C(C=C1)C(=O)O
IUPAC Namedeuterio benzoate
InChIKeyWPYMKLBDIGXBTP-DYCDLGHISA-N
INCHI1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)/i/hD
Isomere SMILES [2H]OC(=O)C1=CC=CC=C1
Alternative CAS-Nummer 65-85-0(unlabelled)
Molekulargewicht 123.13
Reaxy-Rn 1936406
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1936406&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

3D-Struktur
Interaktives chemisches Strukturmodell





Zertifikate (CoA, COO, BSE/TSE und Analyse-Diagramm)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

1 results found

Lot NumberCertificate TypeDatumArtikel
A2521174Certificate of AnalysisJan 14, 2025 B472011
Chemische und physikalische Eigenschaften
LöslichkeitSoluble in water (3.4 mg/ml at 25° C), DMSO (24 mg/ml at 25° C), ethanol (24 mg/ml at 25° C), acetone, and chloroform. (unlabeled)
Brechungsindexn20D 1.56 (Predicted)(unlabelled)
Flammpunkt (°F)Not applicable
Flammpunkt (°C)Not applicable
Siedepunkt (°C)249℃ (lit.)
Schmelzpunkt (°C)121-125℃ (lit.)
Lösungsrechner
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