Chemical Properties of Thiazolo[3,2-a]pyridinium, 2,3-dihydro-8-hydroxy-5-methyl-, hydroxide, inner salt (CAS 23003-43-2)

Thiazolo[3,2-a]pyridinium, 2,3-dihydro-8-hydroxy-5-methyl-, hydroxide, inner salt

InChI
InChI=1S/C8H9NOS/c1-6-2-3-7(10)8-9(6)4-5-11-8/h2-3H,4-5H2,1H3
InChI Key
IJQXSEDDFABXPP-UHFFFAOYSA-N
Formula
C8H9NOS
SMILES
Cc1ccc([O-])c2[n+]1CCS2
Molecular Weight1
167.23
CAS
23003-43-2
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Physical Properties

Property Value Unit Source
ω 0.4256 Relay (1.0) Calculated Property
ΔfG° 186.30 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas 61.94 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 71.80 kJ/mol Relay (1.0) Calculated Property
IE [6.93; 7.35] eV Show Hide
IE 6.93 ± 0.05 eV NIST
IE 6.95 ± 0.05 eV NIST
IE 7.35 ± 0.05 eV NIST
log10WS -1.39 Relay (1.0) Calculated Property
logPoct/wat 0.462 Crippen Calculated Property
McVol 121.160 ml/mol McGowan Calculated Property
Pc 3864.94 kPa Relay (1.0-beta) Calculated Property
Tboil 547.27 K Relay (1.0) Calculated Property
Tc 780.07 K Relay (1.0) Calculated Property
Tfus 409.64 K Relay (1.0) Calculated Property
Vc 0.401 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Sophoramine. Nalmefene, bis(trifluoroacetate). Tinctorine. Hydroxy-N-methylcytisine. Thymidine, 3'-O-acetyl, 5'-O-TBDMS. Methysergide. Heptafluorobutyryl-codeine. Crinan-11-ol, 1,2-didehydro-3-methoxy-, (3«beta»,5«alpha»,11R,13«beta»,19«alpha»)-. [2,2'-Bimorphinan]-3,3',6,6'-tetrol, 7,7',8,8'-tetradehydro-4,5:4',5'-diepoxy-17,17'-dimethyl-, (5«alpha»,6«alpha»)-(5'«alpha»,6'«alpha»)-. Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl- (5«alpha»,6«alpha»)-, bis(trifluoroacetate) (ester). Triazolo[4,5-d]pyrimidin-7-ol,3h-v-, 5-amino-3-(2',3'-o-isopropylidene-beta-d-ribofuranosyl)-, 5'-diphenyl phosphate (keto form). Deserpidine. Paclitaxel. Ergotaman-3',6',18-trione, 9,10-dihydro-12'-hydroxy-2'-methyl-5'-(phenylmethyl)-, (5'«alpha»,10«alpha»)-. Ergotamine.

Find more compounds similar to Thiazolo[3,2-a]pyridinium, 2,3-dihydro-8-hydroxy-5-methyl-, hydroxide, inner salt.

Sources

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