13912-80-6

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13912-80-6 Structure

Identification	Back Directory
[Name] Nicoboxil
[CAS] 13912-80-6
[Synonyms] NICOBOXIL Butoxyethyl Butoxyethyl nicotinate 2-butoxyethyl nicotinate beta-Butoxyethyl nicotinate Nicotinic acid 2-butoxyethyl ester NICOBOXIL, BUTOXYETHYL NICOTINATE 3-Pyridinecarboxylic acid 2-butoxyethyl ester
[EINECS(EC#)] 237-684-7
[Molecular Formula] C12H17NO3
[MDL Number] MFCD00047451
[MOL File] 13912-80-6.mol
[Molecular Weight] 223.27

Chemical Properties	Back Directory
[Boiling point ] 287.4±15.0 °C(Predicted)
[density ] 1.066±0.06 g/cm3(Predicted)
[pka] 3.10±0.10(Predicted)
[InChI] InChI=1S/C12H17NO3/c1-2-3-7-15-8-9-16-12(14)11-5-4-6-13-10-11/h4-6,10H,2-3,7-9H2,1H3
[InChIKey] IZJRISIINLJVBU-UHFFFAOYSA-N
[SMILES] C1=NC=CC=C1C(OCCOCCCC)=O
[LogP] 2.060 (est)

Safety Data	Back Directory
[Symbol(GHS) ] GHS07
[Signal word ] Warning
[Hazard statements ] H302
[Precautionary statements ] P264-P270-P301+P312-P330-P501

Hazard Information	Back Directory
[Uses] Nicoboxil is a medication used in the treatment of acute non-specific low back pains.
[Definition] ChEBI: Beta-Butoxyethyl nicotinate is an aromatic carboxylic acid and a member of pyridines.

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