(3-Methyl-4-oxo-3,4-dihydrophthalazin-1-yl)acetic acid

Base Information

Chemical Name:(3-Methyl-4-oxo-3,4-dihydrophthalazin-1-yl)acetic acid
CAS No.:28081-52-9
Molecular Formula:C11H10 N2 O3
Molecular Weight:218.212
Hs Code.:2933990090
European Community (EC) Number:860-164-1
DSSTox Substance ID:DTXSID50351670
Wikidata:Q82128256
Mol file:28081-52-9.mol

Synonyms:28081-52-9;(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)acetic acid;2-(3-Methyl-4-oxo-3,4-dihydrophthalazin-1-yl)acetic acid;(3-Methyl-4-oxo-3,4-dihydro-phthalazin-1-yl)-acetic acid;2-(3-methyl-4-oxophthalazin-1-yl)acetic acid;MFCD01192103;1-Phthalazineacetic acid, 3,4-dihydro-3-methyl-4-oxo-;CBMicro_025585;Oprea1_063480;Oprea1_753595;SCHEMBL15597471;(3-Methyl-4-oxo-3,4-dihydro-phthalazin-1-yl)acetic acid;DTXSID50351670;BBL003512;CCG-12536;STK137835;AKOS000112014;WAY-301328;VS-01358;BIM-0025470.P001;CS-0089655;FT-0676661;EN300-12980;C13774;A913502;Z89270668;(3-METHYL-4-OXO-3,4-DIHYDRO-PHTHALAZIN-1-YL)-ACETICACID;2-(3-METHYL-4-OXO-3,4-DIHYDRO-1-PHTHALAZINYL)ACETIC ACID;(3-methyl-4-oxo-3,4-dihydro-phthalazin-1-yl)-acetic acid, AldrichCPR

Suppliers and Price of (3-Methyl-4-oxo-3,4-dihydrophthalazin-1-yl)acetic acid

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
2-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)aceticAcid
50mg
$ 90.00

TRC
2-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)aceticAcid
10mg
$ 60.00

Matrix Scientific
(3-Methyl-4-oxo-3,4-dihydro-phthalazin-1-yl)-acetic acid
500mg
$ 168.00

Crysdot
2-(3-Methyl-4-oxo-3,4-dihydrophthalazin-1-yl)aceticacid 95+%
5g
$ 532.00

CHESS?
CA008815:(3-Methyl-4-oxo-3,4-dihydro-phthalazin-1-yl)-aceticacid 97
1 g
$ 288.00

Chemenu
2-(3-Methyl-4-oxo-3,4-dihydrophthalazin-1-yl)aceticacid 95%
5g
$ 502.00

American Custom Chemicals Corporation
(3-METHYL-4-OXO-3,4-DIHYDRO-PHTHALAZIN-1-YL)-ACETIC ACID 95.00%
5G
$ 1337.24

American Custom Chemicals Corporation
(3-METHYL-4-OXO-3,4-DIHYDRO-PHTHALAZIN-1-YL)-ACETIC ACID 95.00%
2.5G
$ 1091.99

American Custom Chemicals Corporation
(3-METHYL-4-OXO-3,4-DIHYDRO-PHTHALAZIN-1-YL)-ACETIC ACID 95.00%
1G
$ 779.78

AK Scientific
(3-Methyl-4-oxo-3,4-dihydro-phthalazin-1-yl)-aceticacid
500mg
$ 276.00

Total 11 raw suppliers

Chemical Property of (3-Methyl-4-oxo-3,4-dihydrophthalazin-1-yl)acetic acid

Chemical Property:

Vapor Pressure:2.16E-08mmHg at 25°C
Boiling Point:436.5°Cat760mmHg
Flash Point:217.8°C
PSA：72.19000
Density:g/cm³
LogP:0.56060
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:218.06914219
Heavy Atom Count:16
Complexity:351

Purity/Quality:

97% ^*data from raw suppliers

2-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)aceticAcid ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xi,Xn
Statements: 22

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1C(=O)C2=CC=CC=C2C(=N1)CC(=O)O

Technology Process of (3-Methyl-4-oxo-3,4-dihydrophthalazin-1-yl)acetic acid

There total 6 articles about (3-Methyl-4-oxo-3,4-dihydrophthalazin-1-yl)acetic acid which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 81.0%

: 356790-62-0
ethyl 2-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)acetate

: 28081-52-9
2-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)acetic acid

Guidance literature:: With lithium hydroxide; In tetrahydrofuran; methanol; water; at 20 ℃;
DOI:10.1016/j.bmcl.2013.07.067

Reference yield:

: 85-44-9
phthalic anhydride

: 28081-52-9
2-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)acetic acid

Guidance literature:: Multi-step reaction with 3 steps

1: chloroform / 16 h / Reflux

2: ethanol / 3 h / Reflux

3: sodium hydroxide / tetrahydrofuran / 2 h / Reflux

With sodium hydroxide; In tetrahydrofuran; ethanol; chloroform; 1: |Wittig Olefination;
DOI:10.1016/j.bmcl.2012.12.037

Reference yield:

: 57691-07-3
ethyl [(E)-3-oxo-1,3-dihydroisobenzofuran-1-ylidene]acetate

: 28081-52-9
2-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)acetic acid

Guidance literature:: Multi-step reaction with 2 steps

1: ethanol / 3 h / Reflux

2: sodium hydroxide / tetrahydrofuran / 2 h / Reflux

With sodium hydroxide; In tetrahydrofuran; ethanol;
DOI:10.1016/j.bmcl.2012.12.037