Chemical Properties of Nicotinamidoxime, o-acetyl- (CAS 296767-16-3)

Nicotinamidoxime, o-acetyl-

InChI
InChI=1S/C8H9N3O2/c1-6(12)13-11-8(9)7-3-2-4-10-5-7/h2-5H,1H3,(H2,9,11)
InChI Key
PVLUBQFJUMTXOO-UHFFFAOYSA-N
Formula
C8H9N3O2
SMILES
CC(=O)ON=C(N)c1cccnc1
Molecular Weight1
179.18
CAS
296767-16-3
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Physical Properties

Property Value Unit Source
ω 0.6838 Relay (1.0) Calculated Property
ΔfG° 134.25 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -38.01 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 81.71 kJ/mol Relay (1.0) Calculated Property
IE 8.57 eV Relay (1.0) Calculated Property
log10WS -1.25 Relay (1.0) Calculated Property
logPoct/wat 0.265 Crippen Calculated Property
McVol 132.900 ml/mol McGowan Calculated Property
Pc 3924.21 kPa Relay (1.0-beta) Calculated Property
Tboil 568.40 K Relay (1.0) Calculated Property
Tc 798.38 K Relay (1.0) Calculated Property
Tfus 376.41 K Relay (1.0) Calculated Property
Vc 0.483 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

2-Furamidoxime, o-(3-pyridinecarbonyl)-5-nitro. Mephenytoin, M (HO-), AC. DL-Nornicotine, N-trimethylsilyl-. Mepindolol, acetylated. oxazolam, acetylated. Mephenytoin. 2H-Cyclohepta[b]furan-2-one, 6-[1-(acetyloxy)-3-oxobutyl]-3,3a,4,7,8,8a-hexahydro-7-methyl-3-methylene-. trans-Dehydroandrosterone, picolinyloxydimethylsilyl ether. tryptophan, trifluoroacetyl-isopropyl ester. RTI 2. 3-Iodo-L-tyrosine, N,O-bis(tert-butyldimethylsilyl)-, tert-butyldimethylsilyl ester. Oxazolam. Metaraminol, N-TFA, bis-O-TMS. 5-Hydroxy-2-(4-hydroxyphenyl)-4-oxo-3,4-dihydro-2h-chromen-7-yl 6-o-(6-deoxyhexopyranosyl)hexopyranoside. Spiro[2H-1-benzopyran-2,2'-[2H]indole], 1',3'-dihydro-1',3',3'-trimethyl-6-nitro-.

Find more compounds similar to Nicotinamidoxime, o-acetyl-.

Sources

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