2-Chloro-3-methoxybenzonitrile - ≥98% , CAS No.853331-52-9

CAS: 853331-52-9 Cat. No.: C300899 Summenformel: H3COC6H3(Cl)CN Molekulargewicht: 167.59 EG-Nummer: 627-318-8
Zu bestellen verfügbar
GRADE & PURITY ≥98%
Synonyms
SCHEMBL2336325 | D73316 | AS-60341 | GEO-04562 | 2-Chloro-3-methoxybenzonitrile | AKOS023428908 | FT-0712358 | 2-Chloro-3-methoxybenzonitrile, 97% | SY129842 | QZCKPEQQNFBXHZ-UHFFFAOYSA-N | MFCD07784400 | DTXSID40584733
Storage
Room temperature
Shipped In
Normal
★
Size
Deutschland (EU)
USA*
Price
Qty
250mg
C300899-250mg
—
5 Auf Lager

52,85€

79,75€
Speichern 26,90 € (33.73%)
1g
C300899-1g
—
4 Auf Lager

97,10€

145,69€
Speichern 48,59 € (33.35%)
5g
C300899-5g
—
3 Auf Lager

288,00€

432,05€
Speichern 144,04 € (33.34%)
10g
C300899-10g
—
5 Auf Lager

518,82€

778,28€
Speichern 259,45 € (33.34%)
25g
C300899-25g
—
4 Auf Lager

1.134,05€

1.701,55€
Speichern 567,50 € (33.35%)
Enter a quantity for the sizes you want to add.
🧪
Why this grade

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

🌡

Storage & shipping

Room temperature Ships Normal 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

Synonyme
SCHEMBL2336325 | D73316 | AS-60341 | GEO-04562 | 2-Chloro-3-methoxybenzonitrile | AKOS023428908 | FT-0712358 | 2-Chloro-3-methoxybenzonitrile, 97% | SY129842 | QZCKPEQQNFBXHZ-UHFFFAOYSA-N | MFCD07784400 | DTXSID40584733
Spezifikationen & Reinheit
≥98%
Storage
Room temperature
Verschickt in
Normal
Reinheit
≥98%
Namen und Kennungen
Pubchem Sid
Kanonisches Lächeln
COC1=CC=CC(=C1Cl)C#N
IUPAC Name
2-chloro-3-methoxybenzonitrile
InChIKey
QZCKPEQQNFBXHZ-UHFFFAOYSA-N
INCHI
1S/C8H6ClNO/c1-11-7-4-2-3-6(5-10)8(7)9/h2-4H,1H3
Isomere SMILES
COC1=CC=CC(=C1Cl)C#N
WGK Deutschland
2
Molekulargewicht
167.59
Reaxy-Rn
18880968
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=18880968&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

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
KlasseBenzene and substituted derivatives
SubclassBenzonitriles
Intermediate Tree Nodes Not available
Direct ParentBenzonitriles
Alternative Parents Phenoxy compounds  Methoxybenzenes  Anisoles  Chlorobenzenes  Alkyl aryl ethers  Aryl chlorides  Nitriles  Organopnictogen compounds  Organochlorides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Anisole - Benzonitrile - Phenol ether - Methoxybenzene - Phenoxy compound - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Ether - Nitrile - Carbonitrile - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic compound
BeschreibungThis 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
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.

11 results found

Lot NumberCertificate TypeDatumArtikel
G23121038Certificate of AnalysisJun 21, 2023 C300899
G23121043Certificate of AnalysisJun 21, 2023 C300899
G23121044Certificate of AnalysisJun 21, 2023 C300899
G23121052Certificate of AnalysisJun 21, 2023 C300899
G23121055Certificate of AnalysisJun 21, 2023 C300899
G23121063Certificate of AnalysisJun 21, 2023 C300899
G23121066Certificate of AnalysisJun 21, 2023 C300899
G23121070Certificate of AnalysisJun 21, 2023 C300899
G23121589Certificate of AnalysisJun 21, 2023 C300899
G23121591Certificate of AnalysisJun 21, 2023 C300899
I2509100Certificate of AnalysisJun 21, 2023 C300899
Chemische und physikalische Eigenschaften
Schmelzpunkt (°C)92-96 °C
Molekulargewicht167.590 g/mol
XLogP32.200
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass167.014 Da
Monoisotopic Mass167.014 Da
Topological Polar Surface Area33.000 Ų
Heavy Atom Count11
Formal Charge0
Complexity174.000
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
Lösungsrechner
Bewertungen

Kundenbewertungen

Shall we send you a message when we have discounts available?

Remind me later

Thank you! Please check your email inbox to confirm.

Oops! Notifications are disabled.