4-Methoxybenzonitrile - ≥99% , CAS No.874-90-8

CAS: 874-90-8 Cat. No.: M111093 分子式: C8H7NO 分子量: 133.15 Beilstein Registry Number: 10(3)344 EC番号: 212-871-6
注文可能
GRADE & PURITY ≥99%
Synonyms
Anisonitrile | 4-anisonitrile | BP-12473 | STR00967 | HMS1760K15 | NSC 3777 | NSC 71539 | NSC3777 | NSC-3777 | 1-methoxy-4-cyano-benzene | AMY4132 | NSC71539 | NSC-71539 | PS-4309 | Tox21_304041 | p-Methoxybenzonitrile | 1-Cyano-4-methoxybenzene | p-Aniso
Storage
Room temperature,Desiccated
Shipped In
Normal
★
Size
USA
ドイツ (EU)*
Price
Qty
5g
M111093-5g
3 在庫あり
—
$14.90
25g
M111093-25g
3 在庫あり
—

$26.90

$49.90
保存 $23.00 (46.09%)
100g
M111093-100g
2 在庫あり
—

$91.90

$159.90
保存 $68.00 (42.53%)
500g
M111093-500g
1 在庫あり
—

$297.90

$559.90
保存 $262.00 (46.79%)
Enter a quantity for the sizes you want to add.
🧪
Why this grade

≥99% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature,Desiccated 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 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

同義語
Anisonitrile | 4-anisonitrile | BP-12473 | STR00967 | HMS1760K15 | NSC 3777 | NSC 71539 | NSC3777 | NSC-3777 | 1-methoxy-4-cyano-benzene | AMY4132 | NSC71539 | NSC-71539 | PS-4309 | Tox21_304041 | p-Methoxybenzonitrile | 1-Cyano-4-methoxybenzene | p-Aniso
仕様と純度
≥99%
保管条件
Room temperature,Desiccated
入荷
Normal
純度
≥99%
名前と識別子
パブケム・シド
パブケム・シド・ウル
https://pubchem.ncbi.nlm.nih.gov/substance/504754490
カノニカル・スマイル
COC1=CC=C(C=C1)C#N
IUPAC Name
4-methoxybenzonitrile
InChIKey
XDJAAZYHCCRJOK-UHFFFAOYSA-N
INCHI
1S/C8H7NO/c1-10-8-4-2-7(6-9)3-5-8/h2-5H,1H3
異性体SMILES
COC1=CC=C(C=C1)C#N
WGKドイツ
3
分子量
133.15
Beilstein
10(3)344
Reaxy-Rn
508117
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=508117&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
分類Benzene and substituted derivatives
SubclassBenzonitriles
Intermediate Tree Nodes Not available
Direct ParentBenzonitriles
Alternative Parents Phenoxy compounds  Methoxybenzenes  Anisoles  Alkyl aryl ethers  Nitriles  Organopnictogen compounds  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Phenoxy compound - Anisole - Benzonitrile - Methoxybenzene - Phenol ether - Alkyl aryl ether - Ether - Carbonitrile - Nitrile - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic compound
説明This 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
3 D構造
インタラクティブ化学構造モデル





作用メカニズム
証明書(CoA、COO、BSE/TSEと分析図)
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.

8 results found

Lot NumberCertificate Type日付商品
D2101388Certificate of AnalysisJan 13, 2025 M111093
D2101389Certificate of AnalysisJan 13, 2025 M111093
D2101427Certificate of AnalysisJan 13, 2025 M111093
I1923076Certificate of AnalysisJul 10, 2023 M111093
B2209269Certificate of AnalysisJan 08, 2022 M111093
B2209270Certificate of AnalysisJan 08, 2022 M111093
B2209274Certificate of AnalysisJan 08, 2022 M111093
B2209509Certificate of AnalysisJan 08, 2022 M111093
化学的性質と物理的性質
溶解度Insoluble in water.
感度Hygroscopic.
沸点(°C)137 °C/20 mmHg
融点(°C)57-60°C
分子量133.150 g/mol
XLogP31.900
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass133.053 Da
Monoisotopic Mass133.053 Da
Topological Polar Surface Area33.000 Ų
Heavy Atom Count10
Formal Charge0
Complexity139.000
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
よくある質問と記事
Citations of This Product
ソリューション計算機
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