Home> Encyclopedia > / Food Additives / Herbal Extract / Pharmaceutical Intermediates / Organic Intermediate / Fungicide

Methyl 3-[[5-[(dimethylamino)carbonyl]-2-pyrazinyl]oxy]-5-[(1S)-2-methoxy-1-methylethoxy]benzoate structure

Methyl 3-[[5-[(dimethylamino)carbonyl]-2-pyrazinyl]oxy]-5-[(1S)-2-methoxy-1-methylethoxy]benzoate structure

Methyl 3-[[5-[(dimethylamino)carbonyl]-2-pyrazinyl]oxy]-5-[(1S)-2-methoxy-1-methylethoxy]benzoate

Iupac Name：7-methoxy-8-(3-methylbut-2-enyl)chromen-2-one

CAS No.：484-12-8

Molecular Weight：244.28574

Request For Quotation

1. Names and Identifiers

1.1 Name: Methyl 3-[[5-[(dimethylamino)carbonyl]-2-pyrazinyl]oxy]-5-[(1S)-2-methoxy-1-methylethoxy]benzoate
1.2 Synonyms: Benzoic acid, 3-[[5-[(dimethylamino)carbonyl]-2-pyrazinyl]oxy]-5-[(1S)-2-methoxy-1-methylethoxy]-, methyl ester

1.3 CAS No.: 484-12-8

1.4 CID: 10228

1.5 Molecular Formula: C₁₃H₁₃N₃O₄ (isomer)

1.6 Inchi: InChI=1S/C15H16O3/c1-10(2)4-7-12-13(17-3)8-5-11-6-9-14(16)18-15(11)12/h4-6,8-9H,7H2,1-3H3

1.7 InChkey: MBRLOUHOWLUMFF-UHFFFAOYSA-N

1.8 Canonical Smiles: CC(=CCC1=C(C=CC2=C1OC(=O)C=C2)OC)C

1.9 Isomers Smiles: CC(=CCC1=C(C=CC2=C1OC(=O)C=C2)OC)C

2. Properties

3.1 Melting point: 83-84 oC

3.1 Refractive index: 1.556

3.1 Vapour pressure: 1.67E-06mmHg at 25°C

3.1 Precise Quality: 244.11000

3.1 PSA: 39.44000

3.1 logP: 3.31030

3. Safety and Handling

4.1 Risk Statements: S26-S36/37-S36/37/39

4.1 Safety Statements: R36/37/38:Irritating to eyes, respiratory system and skin . R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .

4.1 RIDADR: NONH for all modes of transport

4.1 WGK Germany: 3

4.1 RTECS: GN7700000

4. MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

no data available

2.2 GHS label elements, including precautionary statements

Pictogram(s)	no data available
Signal word	no data available
Hazard statement(s)	no data available
Precautionary statement(s)
Prevention	no data available
Response	no data available
Storage	no data available
Disposal	no data available

2.3 Other hazards which do not result in classification

no data available

5. Computational chemical data

Molecular Weight：244.28574g/mol
Molecular Formula：C_₁₃H_₁₃N_₃O_₄
Compound Is Canonicalized：True
XLogP3-AA：3.8
Exact Mass：244.109944368
Monoisotopic Mass：244.109944368
Complexity：366
Rotatable Bond Count：3
Hydrogen Bond Donor Count：0
Hydrogen Bond Acceptor Count：3
Topological Polar Surface Area：35.5
Heavy Atom Count：18
Defined Atom Stereocenter Count：0
Undefined Atom Stereocenter Count：0
Defined Bond Stereocenter Count：0
Undefined Bond Stereocenter Count：0
Isotope Atom Count：0
Covalently-Bonded Unit Count：1

6. Recommended Suppliers

Global317SuppliersView all >>

Hebei Bocao Biological Technology Co., Ltd Diamond member

Diamond member

2YRS

Audited Suppliers

Manufacturer

Products:CBD,443998-65-0,16648-44-5,BMK,PMK
Tel:86-191-31911055
Email:admin@hbbocao.com

Natural Cnidium Monnieri Powder with Oshole 10%~ to 98%/HPLC Cas 484-12-8

Purity:99%Packing: 200kg/bag FOB
Price: 10 USD/kilogram
Time: 2022/05/10

Inquire

Hebei Crovell Biotech Co. Ltd Diamond member

Diamond member

2YRS

Audited Suppliers

Manufacturer

Products:Cosmetic Raw Materials,solvents,etc.
Tel:86-311-66562153
Email:breeduan@crovellbio.com

Natural Cnidium Monnieri Powder with Oshole 10%~ to 98%/HPLC Cas 484-12-8

Purity:99%Packing: 200kg/bag FOB
Price: 10 USD/kilogram
Time: 2022/05/05

Inquire

Hangzhou Dayangchem Co., Ltd. Diamond member

Diamond member

11YRS

Audited Suppliers

Manufacturer

Products:Chemical products
Tel:86-571-88938639
Email:sales-gc@chinadayangchem.com

Osthole

Purity:99%Packing: 200kg/bag FOB
Price: 1 USD/kilogram
Time: 2022/04/28

Inquire

Wuhan Fortuna Chemical Co., Ltd. Diamond member

Diamond member

9YRS

Audited Suppliers

Manufacturer

Products:API
Tel:0086-27-59207850
Email:info@fortunachem.com

Osthole

Purity:99%Packing: 200kg/bag FOB
Price:
Time: 2022/05/21

Inquire

SHANDONG BELIEVE CHEMICAL PTE LTD Diamond member

Diamond member

2YRS

Audited Suppliers

Manufacturer

Products:Pharmaceutical, chemical technology research and development
Tel:086-0532-80960264
Email:derek@believechem.com

Osthole

Purity:99%Packing: 200kg/bag FOB
Price: 1 USD/kilogram
Time: 2022/05/21

Inquire

Directory

1. Names and Identifiers

1.5 Molecular Formula

1.8 Canonical Smiles

1.9 Isomers Smiles

2. Properties

3.1 Melting point

3.1 Refractive index

3.1 Vapour pressure

3.1 Precise Quality

3. Safety and Handling

4.1 Risk Statements

4.1 Safety Statements

4.1 WGK Germany

6.Synthesis Route

7.Computational chemical data

8.Recommended Suppliers