2-Methoxy-6-methylbenzonitrile - ≥97% , CAS No.53005-44-0

CAS: 53005-44-0 Cat. No.: M185007 Formula: C9H9NO Peso molecolare: 147.17
Disponibile su ordine
GRADE & PURITY ≥97%
Synonyms
DTXSID30343518 | AKOS006304878 | 2-CYANO-3-METHYLANISOLE | AM84108 | SCHEMBL2728977 | MFCD10699539 | 2-Methoxy-6-methylbenzonitrile | DS-14221 | SY035421 | FT-0727677 | 2-methyl-6-methoxybenzonitrile | Benzonitrile, 2-methoxy-6-methyl- | 2-Methoxy-6-methy
Storage
Store at 2-8°C
Shipped In
Wet ice
★
Size
Germania (EU)
USA*
Price
Qty
250mg
M185007-250mg
—
3 Disponibile

8,59€

12,93€
Salva 4,34 € (33.56%)
1g
M185007-1g
—
3 Disponibile

19,00€

28,55€
Salva 9,55 € (33.43%)
5g
M185007-5g
—
3 Disponibile

77,14€

116,19€
Salva 39,05 € (33.61%)
Enter a quantity for the sizes you want to add.
🧪
Why this grade

≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C Ships Wet ice Check lot-specific COA for exact specifications.

📋

Quality documents

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

📚

Literature proof

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

Specifications

Sinonimi
DTXSID30343518 | AKOS006304878 | 2-CYANO-3-METHYLANISOLE | AM84108 | SCHEMBL2728977 | MFCD10699539 | 2-Methoxy-6-methylbenzonitrile | DS-14221 | SY035421 | FT-0727677 | 2-methyl-6-methoxybenzonitrile | Benzonitrile, 2-methoxy-6-methyl- | 2-Methoxy-6-methy
Specifiche e purezza
≥97%
Condizioni di conservazione di stoccaggio
Store at 2-8°C
Spedito in
Wet ice
Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.
Purezza
≥97%
Nomi e identificatori
Pubchem Sid
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/528757426
Sorrisi canonici
CC1=C(C(=CC=C1)OC)C#N
IUPAC Name
2-methoxy-6-methylbenzonitrile
InChIKey
ZZZIUEZLZGDVBG-UHFFFAOYSA-N
INCHI
1S/C9H9NO/c1-7-4-3-5-9(11-2)8(7)6-10/h3-5H,1-2H3
Isomeri SMILES
CC1=C(C(=CC=C1)OC)C#N
Peso molecolare
147.17
Reaxy-Rn
3242807
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3242807&ln=

Documentazione

📋 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

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClasseBenzene and substituted derivatives
SubclassBenzonitriles
Intermediate Tree Nodes Not available
Direct ParentBenzonitriles
Alternative Parents Phenoxy compounds  Methoxybenzenes  Anisoles  Toluenes  Alkyl aryl ethers  Nitriles  Organopnictogen compounds  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Phenoxy compound - Anisole - Benzonitrile - Methoxybenzene - Phenol ether - Alkyl aryl ether - Toluene - Ether - Carbonitrile - Nitrile - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic compound
DescrizioneThis compound belongs to the class of organic compounds known as benzonitriles. These are organic compounds containing a benzene bearing a nitrile substituent.
External Descriptors Not available
Struttura 3D
Modello di struttura chimica interattiva





Certificati (CoA, COO, BSE/TSE e tabella di analisi)
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.

3 results found

Lot NumberCertificate TypeDataOggetto
J2514653Certificate of AnalysisAug 08, 2025 M185007
J2514654Certificate of AnalysisAug 08, 2025 M185007
J2514655Certificate of AnalysisAug 08, 2025 M185007
Proprietà chimiche e fisiche
SensibilitàMoisture sensitive
Peso molecolare147.170 g/mol
XLogP32.000
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass147.068 Da
Monoisotopic Mass147.068 Da
Topological Polar Surface Area33.000 Ų
Heavy Atom Count11
Formal Charge0
Complexity170.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Calcolatori di soluzioni
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