Methyl 3-chlorobenzoate - ≥98% , CAS No.2905-65-9

CAS: 2905-65-9 Cat. No.: M192560 Formula: C8H7ClO2 Peso molecolare: 170.59
Disponibile su ordine
GRADE & PURITY ≥98%
Synonyms
AKOS008908780 | 9M3K1L0149 | GS-3376 | NCGC00258565-01 | m-Chlorobenzoic acid methyl ester | METHYL-3-CHLOROBENZOATE | AB00128 | HSDB 5465 | 3-Cl-C6H4-COOCH3 | Q27272727 | DTXCID507507 | 3-(METHOXYCARBONYL)PHENYL CHLORIDE | A819745 | InChI=1/C8H7ClO2/c1-1
Storage
Room temperature
Shipped In
Normal
★
Size
Germania (EU)
USA*
Price
Qty
1g
M192560-1g
—
3 Disponibile
8,59€
5g
M192560-5g
—
1 Disponibile
8,59€
10g
M192560-10g
Su ordinazione · 8–12 settimane
9,46€
25g
M192560-25g
—
2 Disponibile
22,47€
100g
M192560-100g
—
5 Disponibile
78,88€
500g
M192560-500g
—
1 Disponibile
288,00€
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.

Panoramica

The (1+1) Resonance Enhanced Multiphoton Ionisation (REMPI) spectrum and the fluorescence excitation spectrum of methyl 3-chlorobenzoate has been measured in the supersonic free jet. Reaction of methyl 3-chlorobenzoate with lithium diisobutyl-t-butoxyaluminum hydride (LDBBA) has been investigated.

Specifications

Sinonimi
AKOS008908780 | 9M3K1L0149 | GS-3376 | NCGC00258565-01 | m-Chlorobenzoic acid methyl ester | METHYL-3-CHLOROBENZOATE | AB00128 | HSDB 5465 | 3-Cl-C6H4-COOCH3 | Q27272727 | DTXCID507507 | 3-(METHOXYCARBONYL)PHENYL CHLORIDE | A819745 | InChI=1/C8H7ClO2/c1-1
Specifiche e purezza
≥98%
Condizioni di conservazione di stoccaggio
Room temperature
Spedito in
Normal
Purezza
≥98%
Nomi e identificatori
Pubchem Sid
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488182425
Sorrisi canonici
COC(=O)C1=CC(=CC=C1)Cl
IUPAC Name
methyl 3-chlorobenzoate
InChIKey
XRDRKVPNHIWTBX-UHFFFAOYSA-N
INCHI
1S/C8H7ClO2/c1-11-8(10)6-3-2-4-7(9)5-6/h2-5H,1H3
Isomeri SMILES
COC(=O)C1=CC(=CC=C1)Cl
WGK Germania
3
Peso molecolare
170.59
Reaxy-Rn
2045126
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2045126&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
SubclassBenzoic acids and derivatives
Intermediate Tree Nodes Not available
Direct ParentBenzoic acid esters
Alternative Parents 3-halobenzoic acids and derivatives  Benzoyl derivatives  Chlorobenzenes  Aryl chlorides  Methyl esters  Monocarboxylic acids and derivatives  Organooxygen compounds  Organochlorides  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Benzoate ester - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoyl - Halobenzene - Chlorobenzene - Aryl halide - Aryl chloride - Methyl ester - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organochloride - Organohalogen compound - Organic oxygen compound - Aromatic homomonocyclic compound
DescrizioneThis compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.
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.

5 results found

Lot NumberCertificate TypeDataOggetto
K2103217Certificate of AnalysisAug 22, 2024 M192560
K2103218Certificate of AnalysisAug 22, 2024 M192560
K2103220Certificate of AnalysisAug 22, 2024 M192560
K2103251Certificate of AnalysisAug 22, 2024 M192560
K2103255Certificate of AnalysisAug 22, 2024 M192560
Proprietà chimiche e fisiche
Indice di rifrazionen20/D 1.531 (lit.)
Punto di infiammabilità (°F)219.2 °F
Punto di infiammabilità (°C)104 °C
Punto di ebollizione (°C)99-101 °C/12 mmHg (lit.)
Punto di fusione (°C)21 °C (lit.)
Peso molecolare170.590 g/mol
XLogP32.900
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass170.013 Da
Monoisotopic Mass170.013 Da
Topological Polar Surface Area26.300 Ų
Heavy Atom Count11
Formal Charge0
Complexity147.000
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
Recensioni

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