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Phenyl Nicotinate
[CAS# 3468-53-9]

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Identification
Name Phenyl Nicotinate
Synonyms 3-Pyridinecarboxylic Acid Phenyl Ester; Nicotinic Acid Phenyl Ester; Nsc75878
Molecular Structure CAS#: 3468-53-9, Phenyl Nicotinate
Molecular Formula C12H9NO2
Molecular Weight 199.21
CAS Registry Number 3468-53-9
EINECS 222-428-9
SMILES C2=C(C(OC1=CC=CC=C1)=O)C=NC=C2
InChI 1S/C12H9NO2/c14-12(10-5-4-8-13-9-10)15-11-6-2-1-3-7-11/h1-9H
InChIKey QEJPOSAIULNDLU-UHFFFAOYSA-N
Properties
Density 1.2±0.1g/cm3 (Cal.)
Melting point 70-74°C (Expl.)
Boiling point 186-188°C (Expl.)
338.9±15.0°C at 760 mmHg (Cal.)
Flash point 158.8±20.4°C (Cal.)
Safety Data
Safety Code S24;S26;S37/39  Details
Risk Code R37/38;R41;R43  Details
Hazard Symbol symbol  X  Details
Safety Description WARNING: Irritates lungs, eyes, skin
WARNING: May cause irritation, skin or lung sensitization.
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