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41687-30-3

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41687-30-3 Structure

41687-30-3 Structure

Identification	Back Directory
[Name] 2-(3-NITROPHENYLSULFONYL)ETHANOL
[CAS] 41687-30-3
[Synonyms] 2-(3-NITROPHENYLSULFONYL)ETHANOL 2-[(3-nitrophenyl)sulfonyl]-ethano 2-[(3-nitrophenyl)sulphonyl]ethanol (3-Nitrophenyl)β-hydroxyethyl sulfone
[EINECS(EC#)] 255-501-9
[Molecular Formula] C8H9NO5S
[MDL Number] MFCD00134178
[MOL File] 41687-30-3.mol
[Molecular Weight] 231.23

Chemical Properties	Back Directory
[Melting point ] 76-78 °C (lit.)
[Boiling point ] 104.7℃ at 95.992kPa
[density ] 0.588g/cm3 at 32℃
[vapor pressure ] 0Pa at 25℃
[storage temp. ] room temp
[form ] Solid
[pka] 13.56±0.10(Predicted)
[Major Application] diagnostic assay manufacturing hematology histology
[InChI] 1S/C8H9NO5S/c10-4-5-15(13,14)8-3-1-2-7(6-8)9(11)12/h1-3,6,10H,4-5H2
[InChIKey] VMORQDKKMBAQPJ-UHFFFAOYSA-N
[SMILES] OCCS(=O)(=O)c1cccc(c1)[N+]([O-])=O
[LogP] 0.32 at 32℃ and pH4.37
[Dissociation constant] 0-0 at 28℃
[EPA Substance Registry System] Ethanol, 2-[(3-nitrophenyl)sulfonyl]- (41687-30-3)

Safety Data	Back Directory
[Hazard Codes ] Xi
[Risk Statements ] 36/37/38
[Safety Statements ] 26-37/39
[WGK Germany ] 3
[TSCA ] TSCA listed
[REACH Registrations] Inactive
[Storage Class] 11 - Combustible Solids
[Hazard Classifications] Eye Irrit. 2 Skin Irrit. 2 STOT SE 3

Hazard Information	Back Directory
[Uses] diagnostic assay manufacturing hematology histology

Spectrum Detail	Back Directory
[Spectrum Detail] 2-(3-NITROPHENYLSULFONYL)ETHANOL(41687-30-3)¹HNMR 2-(3-NITROPHENYLSULFONYL)ETHANOL(41687-30-3)Raman 2-(3-NITROPHENYLSULFONYL)ETHANOL(41687-30-3)FT-IR 2-(3-NITROPHENYLSULFONYL)ETHANOL(41687-30-3)IR

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