Chemical Properties of Niacinamide (CAS 98-92-0)

Niacinamide

InChI
InChI=1S/C6H6N2O/c7-6(9)5-2-1-3-8-4-5/h1-4H,(H2,7,9)
InChI Key
DFPAKSUCGFBDDF-UHFFFAOYSA-N
Formula
C6H6N2O
SMILES
N=C(O)c1cccnc1
Molecular Weight1
122.12
CAS
98-92-0
Other Names
  • 3-(Aminocarbonyl)pyridine
  • 3-Amidopyridine
  • 3-Carbamoylpyridine
  • 3-Pyridinecarboxylic acid amide
  • 3-pyridinecarboxamide
  • Acid amide
  • Amid kyseliny nikotinove
  • Amide PP
  • Aminicotin
  • Amixicotyn
  • Amnicotin
  • Austrovit PP
  • Benicot
  • Delonin Amide
  • Dipegyl
  • Dipigyl
  • Endobion
  • Factor PP
  • Hansamid
  • Inovitan PP
  • NAM
  • Nandervit-N
  • Niacevit
  • Niamide
  • Niavit PP
  • Nicamide
  • Nicamina
  • Nicamindon
  • Nicasir
  • Nicobion
  • Nicofort
  • Nicogen
  • Nicomidol
  • Nicosan 2
  • Nicosylamide
  • Nicota
  • Nicotamide
  • Nicotilamide
  • Nicotililamido
  • Nicotine acid amide
  • Nicotinic amide
  • Nicotinsaureamid
  • Nicotol
  • Nicotylamide
  • Nicovel
  • Nicovit
  • Nicovitina
  • Nicovitol
  • Nicozymin
  • Nictoamide
  • Niko-tamin
  • Nikotinamid
  • Nikotinsaeureamid
  • Niocinamide
  • Niozymin
  • PP-Faktor
  • Papulex
  • Pelmin
  • Pelmine
  • Pelonin Amide
  • Pyridine, 3-carbamoyl-
  • Pyridine-3-carboxylic acid amide
  • Savacotyl
  • Vi-Nicotyl
  • Vi-noctyl
  • Vitamin B
  • Vitamin B3
  • Vitamin PP
  • Witamina PP
  • b-Pyridinecarboxamide
  • nicotinamide
  • nicotinic acid amide
  • «beta»-Pyridinecarboxamide
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Physical Properties

Property Value Unit Source
ω 0.6882 Relay (1.0) Calculated Property
Δf 59.94 kJ/mol Relay (1.0-beta) Calculated Property
Δfgas -72.03 kJ/mol Relay (1.0) Calculated Property
Δvap 79.34 kJ/mol Relay (1.0) Calculated Property
IE 9.56 eV Relay (1.0) Calculated Property
log10WS -0.46 Relay (1.0) Calculated Property
logPoct/wat 0.965 Crippen Calculated Property
McVol 93.170 ml/mol McGowan Calculated Property
Pc 5808.87 kPa Relay (1.0-beta) Calculated Property
Tboil 569.46 K Relay (1.0) Calculated Property
Tc 843.30 K Relay (1.0) Calculated Property
Tfus [401.70; 404.15] K Show Hide
Tfus 401.70 K (Solid + liquid) phase diagram for (indomethacin + nicotinamide)- methanol or methanol/ethyl acetate mixture and solubility behavior of 1:1 (indomethacin + nicotinamide) co-crystal at T = (298.15 and 313.15) K
Tfus 404.15 K Solubility of Nicotinic Acid and Nicotinamide in Carbon Dioxide at T = (313.15 to 373.15) K and p = (5 to 30) MPa: Experimental Data and Correlation
Ttriple 398.50 K Solubility Determination of Nicotinamide and Its Application for the Cocrystallization with Benzoic Acid
Vc 0.314 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Niacinamide, N-tert.-butyldimethylsilyl-. N-Methyl nicotinimidate, O-trimethylsilyl. Niacin. Nicotinamide, TMS. Nicotinyl alcohol. Diphenyl-(3-pyridyl)carbinol. Oxiniacic acid. Phenyl-(4-chlorophenyl)-(3-pyridyl)carbinol. Methyl nicotinate. Nicotinuric acid, TMS. 3-Pyridinecarboxaldehyde, oxime. Phenyl-(4-methoxyphenyl)-(3-pyridyl)carbinol. Phenyl-(4-hydroxyphenyl)-(3-pyridyl)carbinol. bis-(4-Methoxyphenyl)-(3-pyridyl)carbinol. 3-Pyridinecarboxylic acid, trimethylsilyl ester.

Find more compounds similar to Niacinamide.

Mixtures

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Sources

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