Chemical Properties of Thiazolo[3,2-a]pyridinium, 8-hydroxy-3,5-dimethyl-, hydroxide, inner salt (CAS 30277-00-0)

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

InChI
InChI=1S/C9H9NOS/c1-6-3-4-8(11)9-10(6)7(2)5-12-9/h3-5H,1-2H3
InChI Key
VSJUEYWEHFPCSS-UHFFFAOYSA-N
Formula
C9H9NOS
SMILES
Cc1ccc([O-])c2scc(C)[n+]12
Molecular Weight1
179.24
CAS
30277-00-0
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Physical Properties

Property Value Unit Source
ω 0.4682 Relay (1.0) Calculated Property
ΔfG° 231.65 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas 64.24 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 72.92 kJ/mol Relay (1.0) Calculated Property
IE 6.84 ± 0.05 eV NIST
log10WS -1.89 Relay (1.0) Calculated Property
logPoct/wat 1.177 Crippen Calculated Property
McVol 130.950 ml/mol McGowan Calculated Property
Pc 3849.32 kPa Relay (1.0-beta) Calculated Property
Tboil 550.37 K Relay (1.0) Calculated Property
Tc 810.31 K Relay (1.0) Calculated Property
Tfus 450.05 K Relay (1.0) Calculated Property
Vc 0.447 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Thiazolo[3,2-a]pyridinium, 8-hydroxy-5-methyl-, hydroxide, inner salt. Thiazolo[3,2-a]pyridinium, 8-hydroxy-3-methyl-, hydroxide, inner salt. Norhydrocodone. 5-Methoxytryptophan, ethoxycarbonylated, TBDMS. Aflatoxin G2. Acetyldihydrocodeine. Uridine, 2',3'-bis-O-acetyl, 5'-O-TBDMS. Methyldihydromorphine. Vobassan-17-oic acid, 4-demethyl-3-oxo-, methyl ester. Uridine, 2'-O-acetyl, 3',5'-bis-O-TBDMS. Benazepril Me. Hydrocodone. Thymidine, 3'-O-acetyl, 5'-O-TBDMS. 9H-purine-6(1h)-thione, 9-beta-d-ribofuranosyl-, 2',3'-diacetate, 5'-bis(3,5-dimethylphenyl)phosphate. Hydromorphone.

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

Sources

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