| Identification | More | [Name]
2-NITROPHLOROGLUCINOL | [CAS]
16600-92-3 | [Synonyms]
1,3,5-TRIHYDROXY-2-NITROBENZENE
1-NITROPHLOROGLUCINOL
2,4,6-TRIHYDROXYNITROBENZENE
2-NITROBENZENE-1,3,5-TRIOL
2-NITROPHLOROGLUCINOL
NITROPHLOROGLUCINOL
1-nitro-2,4,6-trihydroxybenzene
2-Nitro-1,3,5-benzenetriol | [EINECS(EC#)]
240-656-7 | [Molecular Formula]
C6H5NO5 | [MDL Number]
MFCD00016996 | [Molecular Weight]
171.11 | [MOL File]
16600-92-3.mol |
| Chemical Properties | Back Directory | [Melting point ]
189-193 °C (lit.) | [Boiling point ]
343.0±22.0 °C(Predicted) | [density ]
1.771±0.06 g/cm3(Predicted) | [storage temp. ]
Inert atmosphere,Room Temperature | [solubility ]
DMSO (Slightly), Methanol (Slightly) | [form ]
Solid | [pka]
4.92±0.20(Predicted) | [color ]
Red | [BRN ]
1963331 | [InChI]
1S/C6H5NO5/c8-3-1-4(9)6(7(11)12)5(10)2-3/h1-2,8-10H | [InChIKey]
QSVQZFVXAUGEMT-UHFFFAOYSA-N | [SMILES]
Oc1cc(O)c(c(O)c1)[N+]([O-])=O | [CAS DataBase Reference]
16600-92-3(CAS DataBase Reference) |
| Safety Data | Back Directory | [Hazard Codes ]
Xi | [Risk Statements ]
R36/37/38:Irritating to eyes, respiratory system and skin . | [Safety Statements ]
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37:Wear suitable protective clothing and gloves . | [WGK Germany ]
3
| [HS Code ]
29089990 | [Storage Class]
11 - Combustible Solids | [Hazard Classifications]
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3 |
| Hazard Information | Back Directory | [Uses]
2-Nitrophloroglucinol is a useful synthetic intermediate. It is used to prepare benzoxazoles and benzothiazoles as selective ligands for human β-estrogen receptor (ER-β). | [Definition]
ChEBI: 2-nitrobenzene-1,3,5-triol is a benzenetriol. It is functionally related to a nitrobenzene. |
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Alfa Aesar
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Energy Chemical
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Sigma-Aldrich
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Cool Pharm, Ltd
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