4-(4-Methylphenoxy)benzoic acid - ≥97% , CAS No.21120-65-0

CAS: 21120-65-0 Cat. No.: M168537 분자식: C14H12O3 분자량: 228.24 EC 번호: 622-641-0
주문 가능
GRADE & PURITY ≥97%
Synonyms
4-(|p|-Tolyloxy)benzoic Acid
Storage
Room temperature
Shipped In
Normal
★
Size
USA
독일 (EU)*
Price
Qty
1g
M168537-1g
3 재고 있음
—

US$47.90

US$71.90
저장 US$24.00 (33.38%)
5g
M168537-5g
1 재고 있음
—

US$187.90

US$281.90
저장 US$94.00 (33.35%)
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

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

동의어
4-( | p | -Tolyloxy)benzoic Acid
사양 및 순도
≥97%
보관 조건
Room temperature
배송
Normal
순수함
≥97%
이름과 식별자
Pubchem Sid
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488189322
정식 스마일
CC1=CC=C(C=C1)OC2=CC=C(C=C2)C(=O)O
IUPAC Name
4-(4-methylphenoxy)benzoic acid
InChIKey
DCDYPMNXCDXNJZ-UHFFFAOYSA-N
INCHI
1S/C14H12O3/c1-10-2-6-12(7-3-10)17-13-8-4-11(5-9-13)14(15)16/h2-9H,1H3,(H,15,16)
이성체 SMILES
CC1=CC=C(C=C1)OC2=CC=C(C=C2)C(=O)O
WGK 독일
3
UN 번호
3077
포장 그룹
III
분자량
228.24
Reaxy-Rn
2649263
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2649263&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
분류Benzene and substituted derivatives
SubclassDiphenylethers
Intermediate Tree Nodes Not available
Direct ParentDiphenylethers
Alternative Parents Diarylethers  Benzoic acids  Phenoxy compounds  Phenol ethers  Benzoyl derivatives  Toluenes  Monocarboxylic acids and derivatives  Carboxylic acids  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Diphenylether - Diaryl ether - Benzoic acid or derivatives - Benzoic acid - Phenoxy compound - Benzoyl - Phenol ether - Toluene - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Organic oxygen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic homomonocyclic compound
설명This compound belongs to the class of organic compounds known as diphenylethers. These are aromatic compounds containing two benzene rings linked to each other through an ether group.
External Descriptors Not available
3D 구조
상호 작용 화학 구조 모델





인증서(CoA, COO, BSE/TSE 및 분석 차트)
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.

2 results found

Lot NumberCertificate Type날짜항목
L2404164Certificate of AnalysisDec 09, 2024 M168537
D2022070Certificate of AnalysisFeb 23, 2024 M168537
화학 및 물리적 특성
녹는점(°C)178-182°C
분자량228.240 g/mol
XLogP33.800
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass228.079 Da
Monoisotopic Mass228.079 Da
Topological Polar Surface Area46.500 Ų
Heavy Atom Count17
Formal Charge0
Complexity248.000
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
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