ChemicalBook--->CAS DataBase List--->7659-29-2

7659-29-2

7659-29-2 Structure

7659-29-2 Structure
IdentificationBack Directory
[Name]

3,5-DINITROCATECHOL
[CAS]

7659-29-2
[Synonyms]

OR-486
Ro-01-2812
3,5-Dinitroactechol
3,5-DINITROCATECHOL
Entacapone impurity E
3,5-dinitropyrocatechol
3,5-dinitro-2-benzenediol
3,5-DINITRO-1,2-BENZENEDIOL
3,5-dinitrobenzene-1,2-diol
1,2-Dihydroxy-3,5-dinitrobenzene
1,2-Benzenediol, 3,5-dinitro- (9CI)
3,5-Dinitro-1,2-benzenediol, OR-486
Imp. E (EP):3,5-Dinitrobenzene-1,2-diol
Entacapone Impurity 5(Entacapone EP Impurity E)
Entacapone Impurity 5(Entacapone EP Impurity A)
Entacapone Impurity 21(Entacapone EP Impurity E)
3,5-DINITROCATECHOL (OR-486) (SELECTIVE INHIBITOR OF CATECHOL
[Molecular Formula]

C6H4N2O6
[MDL Number]

MFCD00069263
[MOL File]

7659-29-2.mol
[Molecular Weight]

200.11
Chemical PropertiesBack Directory
[Melting point ]

166-166.5℃
[Boiling point ]

354.5±42.0 °C(Predicted)
[density ]

1.819±0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C
[solubility ]

H2O: 0.17 mg/mL Solutions may be stored for several days at 4 °C., slightly soluble
[form ]

solid
[pka]

3.85±0.44(Predicted)
[color ]

yellow
[biological source]

synthetic (organic)
[Water Solubility ]

H2O: slightly soluble 0.17mg/mL
45% (w/v) aq 2-hydroxypropyl-β-cyclodextrin: 2.8mg/mL
0.1 M HCl: slightly soluble
DMSO: soluble
aqueous buffer pH > 5: soluble
ethanol: soluble
[InChI]

1S/C6H4N2O6/c9-5-2-3(7(11)12)1-4(6(5)10)8(13)14/h1-2,9-10H
[InChIKey]

VDCDWNDTNSWDFJ-UHFFFAOYSA-N
[SMILES]

Oc1cc(cc(c1O)[N+]([O-])=O)[N+]([O-])=O
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H335-H302-H319
[Precautionary statements ]

P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
[WGK Germany ]

3
[RTECS ]

CZ8947010
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Uses]

OR 486 is an anti-inflammatory agent used in the treatment of rheumatoid arthritis and osteoarthritis. Entacapone (E588500) impurity.
[Biological Activity]

Potent and selective inhibitor of catechol-O-methyl-transferase.
[storage]

Store at RT
Spectrum DetailBack Directory
[Spectrum Detail]

3,5-DINITROCATECHOL(7659-29-2)1HNMR
7659-29-2 suppliers list
Company Name: 3B Pharmachem (Wuhan) International Co.,Ltd.  
Telephone: 18930552037
Website: www.chemicalbook.com/showsupplierproductslist13285/0_en.htm
Company Name: Shanghai T&W Pharmaceutical Co., Ltd.  
Telephone: +86 21 61551611
Website: www.trustwe.com
Company Name: Quality Control Solutions Ltd.  
Telephone: 0755-66853366 13670046396
Website: www.qcsrm.com
Company Name: Shanghai Kewel Chemical Co., Ltd.  
Telephone: 021-64609169 18901607656
Website: http://www.kewelchem.com/
Company Name: Nanjing XiZe Biotechnology CO., Ltd.  
Telephone: 025-66023220 15250997978
Website: http://www.njxizebio.com
Company Name: Shanghai YuanYe Biotechnology Co., Ltd.  
Telephone: 15026964105
Website: www.shyuanye.com
Company Name: Tonichem Pharmaceutical Technology Co., Ltd.  
Telephone: +86 (0752) 222-7171, +86 15815821171
Website: www.tonichem.com
Company Name: Shenzhen Polymeri Biochemical Technology Co., Ltd.  
Telephone: +86-400-002-6226
Website: https://www.rrkchem.com
Company Name: TOSUN PHARM  
Telephone: 020-66392521-118 18922260391
Website: www.toref.cn/
Company Name: sgtlifesciences pvt ltd  
Telephone: +91-8790379245
Website: https://www.chemicalbook.com/ShowSupplierProductsList1846349/0.htm
Company Name: Guangzhou Dreampharm Biotechnology Co., Ltd.  
Telephone: 020-36607679; 13502246435
Website: http://www.dmstandards.com/
Company Name: Guangzhou Jiuzhi Pharmaceutical Technology Co., Ltd.  
Telephone: 020-89854820
Website: http://www.jzpharma.cn
Company Name: ChemeGen(Shanghai) Biotechnology Co.,Ltd.  
Telephone: 18818260767
Website: http://www.chemegen.com
Company Name: Nanjing wangzhixing Pharmaceutical Technology Co., Ltd  
Telephone: 18569809817
Website: www.wzxchem.com
Company Name: Nanjing Tianyi Chemical Technology Co., Ltd  
Telephone: 15150528611
Website: http://www.njtyhgkjyxgs.com
Company Name: Shenzhen Jianyi Biotechnology Co., Ltd  
Telephone: 0755-84826604
Website: www.jeanchemical.com
Company Name: Wuxi Minglu Medicine technology Co.,Ltd.  
Telephone: 0510-88726693
Website: http://www.mlupharm.com
Company Name: Meng Cheng Technology (Shanghai) Co., LTD  
Telephone: 400-820-6829
Website: www.mitachieve.com
Tags:7659-29-2 Related Product Information
1364322-41-7 857629-79-9 1150310-15-8 274-07-7 146698-91-1 84211-30-3 116313-85-0 145195-63-7 857629-78-8 130929-57-6 4097-63-6 158069-75-1 158693-04-0 160391-70-8 1217439-96-7 314058-42-9 158693-01-7 1202160-40-4