Methyl asterrate - ≥95%(LC/MS-UV) , CAS No.59170-17-1

CAS: 59170-17-1 Cat. No.: M463958 분자식: C18H18O8 분자량: 362.33
주문 가능
GRADE & PURITY ≥95%(LC/MS-UV)
Synonyms
ACon1_000170 | AKOS040734686 | Methyl asterrate, >=95% (LC/MS-UV) | NCGC00180813-01 | methyl 2-hydroxy-6-(4-hydroxy-2-methoxy-6-methoxycarbonylphenoxy)-4-methylbenzoate | ACon0_000931 | CHEBI:181231 | Methyl Asterrate | BRD-K81747381-001-01-0 | L007435 |
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
Size
USA
독일 (EU)*
Price
Qty
1mg
M463958-1mg
주문제작 · 8~12주

US$752.90

US$878.90
저장 US$126.00 (14.34%)
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥95%(LC/MS-UV) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at -20°C Ships Ice chest + Ice pads 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.

개요

Description

Natural product derived from fungal source.

Specifications

동의어
ACon1_000170 | AKOS040734686 | Methyl asterrate, >=95% (LC/MS-UV) | NCGC00180813-01 | methyl 2-hydroxy-6-(4-hydroxy-2-methoxy-6-methoxycarbonylphenoxy)-4-methylbenzoate | ACon0_000931 | CHEBI:181231 | Methyl Asterrate | BRD-K81747381-001-01-0 | L007435 |
사양 및 순도
≥95%(LC/MS-UV)
보관 조건
Store at -20°C
배송
Ice chest + Ice pads
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순수함
≥95%(LC/MS-UV)
이름과 식별자
정식 스마일CC1=CC(=C(C(=C1)OC2=C(C=C(C=C2OC)O)C(=O)OC)C(=O)OC)O
IUPAC Namemethyl 2-hydroxy-6-(4-hydroxy-2-methoxy-6-methoxycarbonylphenoxy)-4-methylbenzoate
InChIKeyKYDNOVLBVBYOSW-UHFFFAOYSA-N
INCHI1S/C18H18O8/c1-9-5-12(20)15(18(22)25-4)13(6-9)26-16-11(17(21)24-3)7-10(19)8-14(16)23-2/h5-8,19-20H,1-4H3
이성체 SMILES CC1=CC(=C(C(=C1)OC2=C(C=C(C=C2OC)O)C(=O)OC)C(=O)OC)O
분자량 362.33
Reaxy-Rn 2710119
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2710119&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 o-Hydroxybenzoic acid esters  m-Hydroxybenzoic acid esters  Diarylethers  M-methoxybenzoic acids and derivatives  Salicylic acid and derivatives  Methoxyphenols  Anisoles  Benzoyl derivatives  Meta cresols  Methoxybenzenes  Phenoxy compounds  Toluenes  Alkyl aryl ethers  1-hydroxy-2-unsubstituted benzenoids  1-hydroxy-4-unsubstituted benzenoids  Vinylogous acids  Methyl esters  Hydrocarbon derivatives  Organic oxides  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Diphenylether - M-hydroxybenzoic acid ester - O-hydroxybenzoic acid ester - Diaryl ether - M-methoxybenzoic acid or derivatives - Benzoate ester - Methoxyphenol - Salicylic acid or derivatives - Benzoic acid or derivatives - Phenoxy compound - Anisole - Benzoyl - Methoxybenzene - M-cresol - Phenol ether - Alkyl aryl ether - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Toluene - Phenol - Vinylogous acid - Methyl ester - Carboxylic acid ester - Ether - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organic oxygen compound - 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





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작용 메커니즘
인증서(CoA, COO, BSE/TSE 및 분석 차트)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
화학 및 물리적 특성
용해성 DMSO: 1mg/mL
발화점(°F)Not applicable
발화점(°C)Not applicable
분자량362.300 g/mol
XLogP33.300
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count7
Exact Mass362.1 Da
Monoisotopic Mass362.1 Da
Topological Polar Surface Area112.000 Ų
Heavy Atom Count26
Formal Charge0
Complexity496.000
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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