Chemical Properties of Nicotinic acid, 1,2-dihydro-4,6-dimethyl-2-oxo-,ethyl ester (CAS 16108-48-8)

Nicotinic acid, 1,2-dihydro-4,6-dimethyl-2-oxo-,ethyl ester

InChI
InChI=1S/C10H13NO3/c1-4-14-10(13)8-6(2)5-7(3)11-9(8)12/h5H,4H2,1-3H3,(H,11,12)
InChI Key
GZBUMXFWJBMWEE-UHFFFAOYSA-N
Formula
C10H13NO3
SMILES
CCOC(=O)c1c(C)cc(C)nc1O
Molecular Weight1
195.22
CAS
16108-48-8
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Physical Properties

Property Value Unit Source
ω 0.7144 Relay (1.0) Calculated Property
ΔfG° -243.18 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -542.73 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 89.21 kJ/mol Relay (1.0) Calculated Property
IE 8.34 eV Relay (1.0) Calculated Property
log10WS -3.00 Relay (1.0) Calculated Property
logPoct/wat 1.581 Crippen Calculated Property
McVol 151.290 ml/mol McGowan Calculated Property
Pc 3127.80 kPa Relay (1.0-beta) Calculated Property
Tboil 551.05 K Relay (1.0) Calculated Property
Tc 778.81 K Relay (1.0) Calculated Property
Tfus 399.93 K Relay (1.0) Calculated Property
Vc 0.554 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

7-[(2-hydroxy-2-phenylacetyl)amino]-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid. Poligodial + Phe (methyl ester) adduct, (R). Poligodial + Phe (methyl ester) adduct, (S). Rhodoporphyrin-XV dimethyl ester, bis(trimethylsyloxy)silicon(IV) derivative. 7-Angeloyl-1-formyl-6,7-dihydro-5H-pyrrolizine. 3-Tropoyloxy-6-acetoxytropane. Ipanguline A4. Poligodial + o-Tyr (ethyl ester) adduct (R,S), acetylated, # 1. Oxycodone, trimethylsilyl ether. 1H-Indole-3-ethanol, 2-(5-ethenyl-1-azabicyclo[2.2.2]oct-2-yl)-, [1S-(1«alpha»,2«alpha»,4«alpha»,5«beta»)]-. Oxycodone. 5-Hydroxy-tetraline-cis-2,3-diol, ferrocenylboronate. Tinctorine. Sophoramine. Oxymorphone.

Find more compounds similar to Nicotinic acid, 1,2-dihydro-4,6-dimethyl-2-oxo-,ethyl ester.

Sources

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