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(2-Butyl-5-nitrobenzofuran-3-yl)(4-hydroxyphenyl)methanone Structure

(2-Butyl-5-nitrobenzofuran-3-yl)(4-hydroxyphenyl)methanone

Chemical Properties

Melting point 129 - 131°C
Boiling point 559.5±50.0 °C(Predicted)
Density  1.302±0.06 g/cm3(Predicted)
vapor pressure  0Pa at 25℃
storage temp.  Sealed in dry,Room Temperature
solubility  Chloroform (Slightly), Methanol (Slightly)
pka 7.40±0.15(Predicted)
form  Solid
color  White to Off-White
Water Solubility  220μg/L at 20℃
InChI InChI=1S/C19H17NO5/c1-2-3-4-17-18(19(22)12-5-8-14(21)9-6-12)15-11-13(20(23)24)7-10-16(15)25-17/h5-11,21H,2-4H2,1H3
InChIKey ZJZKLBXEGZKOBW-UHFFFAOYSA-N
SMILES C(C1C2=CC([N+]([O-])=O)=CC=C2OC=1CCCC)(C1=CC=C(O)C=C1)=O
LogP 3.72 at 24℃
FDA UNII 73HKT5L2NJ

Safety

Symbol(GHS)
Signal wordDanger
Hazard statements H302+H312-H315-H318-H411
Precautionary statements P264-P270-P273-P280-P301+P312+P330-P302+P352+P312-P305+P351+P338+P310-P332+P313-P391-P501
HS Code  2932996560

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