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  • 4122-56-9 Structure
  • Basic information

    1. Product Name: Methyl 2-formylbenzoate
    2. Synonyms: Benzoicacid,2-formyl-,methylester;METHYL 2-FORMYLBENZENECARBOXYLATE;METHYL 2-FORMYLBENZOATE;2-CARBOMETHOXYBENZALDEHYDE;2-FORMYLBENZOICACIDMETHYLESTER;Phthalaldehydic acid methyl ester;Methyl 2-formylbenzoate ,97%
    3. CAS NO:4122-56-9
    4. Molecular Formula: C9H8O3
    5. Molecular Weight: 164.16
    6. EINECS: N/A
    7. Product Categories: Aromatic Esters;Aromatic Building Blocks
    8. Mol File: 4122-56-9.mol
    9. Article Data: 96
  • Chemical Properties

    1. Melting Point: 50 °C
    2. Boiling Point: 88 °C
    3. Flash Point: 122.171 °C
    4. Appearance: /
    5. Density: 1.181 g/cm3
    6. Vapor Pressure: 0.004mmHg at 25°C
    7. Refractive Index: 1.5411
    8. Storage Temp.: Keep in dark place,Sealed in dry,Room Temperature
    9. Solubility: N/A
    10. CAS DataBase Reference: Methyl 2-formylbenzoate(CAS DataBase Reference)
    11. NIST Chemistry Reference: Methyl 2-formylbenzoate(4122-56-9)
    12. EPA Substance Registry System: Methyl 2-formylbenzoate(4122-56-9)
  • Safety Data

    1. Hazard Codes: Xi
    2. Statements: 36/37/38-20/21/22
    3. Safety Statements: 24/25-36/37/39-26
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: IRRITANT
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 4122-56-9(Hazardous Substances Data)

4122-56-9 Usage

Chemical Properties

Light yellow liquid

Check Digit Verification of cas no

The CAS Registry Mumber 4122-56-9 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 4,1,2 and 2 respectively; the second part has 2 digits, 5 and 6 respectively.
Calculate Digit Verification of CAS Registry Number 4122-56:
(6*4)+(5*1)+(4*2)+(3*2)+(2*5)+(1*6)=59
59 % 10 = 9
So 4122-56-9 is a valid CAS Registry Number.
InChI:InChI=1/C9H8O3/c1-12-9(11)8-5-3-2-4-7(8)6-10/h2-6H,1H3

4122-56-9SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 13, 2017

Revision Date: Aug 13, 2017

1.Identification

1.1 GHS Product identifier

Product name Methyl 2-formylbenzoate

1.2 Other means of identification

Product number -
Other names methyl benzaldehyde-2-carboxylate

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:4122-56-9 SDS

4122-56-9Relevant articles and documents

Asymmetric alkynylation/lactamization cascade: An expeditious entry to enantiomerically enriched isoindolinones

Bisai, Vishnumaya,Suneja, Arun,Singh, Vinod K.

, p. 10737 - 10741 (2014)

An unprecedented CuI-pybox-diPh-catalyzed highly enantioselective (up to >99% ee) alkynylation/lactamization cascade has been developed as a general catalytic system for the synthesis of diversely substituted isoindolinones of immense biologica

Structural Characterization of the Hydratase-Aldolases, NahE and PhdJ: Implications for the Specificity, Catalysis, and N-Acetylneuraminate Lyase Subgroup of the Aldolase Superfamily

Levieux, Jake A.,Medellin, Brenda,Johnson, William H.,Erwin, Kaci,Li, Wenzong,Johnson, Ingrid A.,Zhang, Yan Jessie,Whitman, Christian P.

, p. 3524 - 3536 (2018)

NahE and PhdJ are bifunctional hydratase-aldolases in bacterial catabolic pathways for naphthalene and phenanthrene, respectively. Bacterial species with these pathways can use polycyclic aromatic hydrocarbons (PAHs) as sole sources of carbon and energy.

-

Eliel,Burgstahler

, p. 2251 (1949)

-

PhIO-Mediated oxidative dethioacetalization/dethioketalization under water-free conditions

Du, Yunfei,Ouyang, Yaxin,Wang, Xi,Wang, Xiaofan,Yu, Zhenyang,Zhao, Bingyue,Zhao, Kang

, p. 48 - 65 (2021/06/16)

Treatment of thioacetals and thioketals with iodosobenzene in anhydrous DCM conveniently afforded the corresponding carbonyl compounds in high yields under water-free conditions. The mechanistic studies indicate that this dethioacetalization/dethioketalization process does not need water and the oxygen of the carbonyl products comes from the hypervalent iodine reagent.

Influence of the proton relay spacer on hydrogen electrocatalysis by cobalt hangman porphyrins

Roubelakis, Manolis M.,Bediako, D. Kwabena,Dogutan, Dilek K.,Nocera, Daniel G.

, p. 714 - 723 (2021/06/21)

A cobalt hangman porphyrin system with a phenyl spacer between the porphyrin ring and an internal carboxylic acid group as well as its non-hangman analogue were synthesized and utilized for the study of the proton-coupled electron transfer (PCET) kinetics

Cobalt Corroles as Electrocatalysts for Water Oxidation: Strong Effect of Substituents on Catalytic Activity

Neuman, Nicolás I.,Albold, Uta,Ferretti, Eleonora,Chandra, Shubhadeep,Steinhauer, Simon,R?ner, Paul,Meyer, Franc,Doctorovich, Fabio,Vaillard, Santiago E.,Sarkar, Biprajit

supporting information, p. 16622 - 16634 (2020/12/02)

Two Co(III) complexes (1Py2 and 2Py2) of new corrole ligands H3L1 (5,15-bis(p-methylcarboxyphenyl)-10-(o-methylcarboxyphenyl)corrole) and H3L2 (5,15-bis(p-nitrophenyl)-10-(o-methylcarboxyphenyl)corrole) with two apical pyridine ligands have been synthesized and thoroughly characterized by cyclic voltammetry, UV-vis-NIR, and EPR spectroscopy, spectroelectrochemistry, single-crystal X-ray diffraction studies, and DFT methods. Complexes 1Py2 and 2Py2 possess much lower oxidation potentials than cobalt(III)-tris-pentafluorophenylcorrole (Co(tpfc)) and similar corroles containing pentafluorophenyl (C6F5) substituents, thus allowing access to high oxidation states of the former metallocorroles using mild chemical oxidants. The spectroscopic (UV-vis-NIR and EPR) and electronic properties of several oxidation states of these complexes have been determined by a combination of the mentioned methods. Complexes 1Py2 and 2Py2 undergo three oxidations within 1.3 V vs FcH+/FcH in MeCN, and we show that both complexes catalyze water oxidation in an MeCN/H2O mixture upon the third oxidation, with kobs (TOF) values of 1.86 s-1 at 1.29 V (1Py2) and 1.67 s-1 at 1.37 V (2Py2). These values are five times higher than previously reported TOF values for C6F5-substituted cobalt(III) corroles, a finding we ascribe to the additional charge in the corrole macrocycle due to the increased oxidation state. This work opens up new possibilities in the study of metallocorrole water oxidation catalysts, particularly by allowing spectroscopic probing of high-oxidation states and showing strong substituent-effects on catalytic activity of the corrole complexes.

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