Cas no 940-07-8 (H2PYZ)

H2PYZ structure
H2PYZ structure
Product Name:H2PYZ
CAS No:940-07-8
MF:C6H4N2O4
MW:168.106961250305
MDL:MFCD08694102
CID:797316
PubChem ID:11601391
Update Time:2024-10-25

H2PYZ Chemical and Physical Properties

Names and Identifiers

    • Pyrazine-2,6-dicarboxylic acid
    • 2,6-Pyrazinedicarboxylic acid
    • 2,6-Ppyrazinedicarboxylic acid
    • 2,6-Pyrazin-dicarbonsaeure
    • Pyrazin-2,5-dicarbonsaeure
    • Pyrazin-2,6-dicarbonsaeure
    • AK126265
    • FCH862682
    • AX8221131
    • ST24049052
    • H2PYZ
    • AKOS000279993
    • SCHEMBL69399
    • DTXSID90469283
    • CS-W022938
    • 940-07-8
    • A10549
    • Pyrazine-2,6-dicarboxylicAcid
    • TS-00144
    • MFCD08694102
    • MDL: MFCD08694102
    • Inchi: 1S/C6H4N2O4/c9-5(10)3-1-7-2-4(8-3)6(11)12/h1-2H,(H,9,10)(H,11,12)
    • InChI Key: CGGUNVYOABLSQD-UHFFFAOYSA-N
    • SMILES: O=C(C1C=NC=C(C(O)=O)N=1)O

Computed Properties

  • Exact Mass: 168.01700
  • Monoisotopic Mass: 168.01710661g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 186
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 100
  • XLogP3: -0.5

Experimental Properties

  • Color/Form: No data available
  • Density: 1.665±0.06 g/cm3 (20 oC 760 Torr),
  • Melting Point: 225 oC
  • Boiling Point: 491.3±45.0 °C at 760 mmHg
  • Flash Point: 250.9±28.7 °C
  • Solubility: Soluble (639 g/l) (25 o C),
  • PSA: 100.38000
  • LogP: -0.12700

H2PYZ Security Information

H2PYZ Customs Data

  • HS CODE:2933990090
  • Customs Data:

    China Customs Code:

    2933990090

    Overview:

    2933990090. Other heterocyclic compounds containing only nitrogen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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H2PYZ Production Method

Production Method 1

Reaction Conditions
1.1 Solvents: Water
Reference
Pyrazine derivatives. II. Preparation of pyrazine-2,3,5-tricarboxylic acid and of pyrazine-2,5- and -2,6-dicarboxylic acids
Mager, H. I. X.; Berends, W., Recueil des Travaux Chimiques des Pays-Bas et de la Belgique, 1958, 77, 827-41

Production Method 2

Reaction Conditions
Reference
A comparison of sensitized Ln(III) emission using pyridine- and pyrazine-2,6-dicarboxylates
Moore, Evan G., Dalton Transactions, 2012, 41(17), 5272-5279

Production Method 3

Reaction Conditions
1.1 Reagents: Lithium hydroxide Solvents: Tetrahydrofuran ,  Water ;  overnight, rt
Reference
Preparation of bis(amino acid) derivatives as inhibitors of human immunodeficiency virus replication and use for the treatment of HIV infection
, World Intellectual Property Organization, , ,

Production Method 4

Reaction Conditions
1.1 Reagents: Sodium hydroxide Solvents: Tetrahydrofuran ,  Water ;  1 h, rt
1.2 Reagents: Hydrochloric acid Solvents: Water ;  acidified
Reference
Pyrazine-functionalized calix[4]arenes: synthesis by palladium-catalyzed cross-coupling with phosphorus pronucleophiles and metal ion extraction properties
Nikishkin, Nicolai I.; Huskens, Jurriaan; Ansari, Seraj A.; Mohapatra, Prasanta K.; Verboom, Willem, New Journal of Chemistry, 2013, 37(2), 391-402

Production Method 5

Reaction Conditions
1.1 Reagents: Selenium dioxide Solvents: Pyridine ,  Water ;  reflux
Reference
Simple and efficient access to pyrazine-2,5- and -2,6-dicarbaldehydes
Coufal, Radek; Pruskova, Marketa; Cisarova, Ivana; Drahonovsky, Dusan; Vohlidal, Jiri, Synthetic Communications, 2016, 46(4), 348-354

Production Method 6

Reaction Conditions
Reference
Product class 14: pyrazines
Sato, N., Science of Synthesis, 2004, 16, 751-844

Production Method 7

Reaction Conditions
Reference
Synthesis and identification of isomeric methylpyrazine derivatives
Fujii, Shoji; Matsumoto, Masao; Kobatake, Hiroshi, Journal of Organic Chemistry, 1980, 45(9), 1693-5

Production Method 8

Reaction Conditions
Reference
Pyrazine derivatives. IV. Coupling constants and chemical shifts in disubstituted pyrazines
Uchimaru, Fumihiko; Okada, Seizaburo; Kosasayama, Akira; Konno, Tsuneo, Chemical & Pharmaceutical Bulletin, 1972, 20(10), 2204-8

H2PYZ Raw materials

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