Chemical Properties of 3-Methylbenzo[b]thiophene-2-carboxaldehyde (CAS 22053-74-3)

3-Methylbenzo[b]thiophene-2-carboxaldehyde

InChI
InChI=1S/C10H8OS/c1-7-8-4-2-3-5-9(8)12-10(7)6-11/h2-6H,1H3
InChI Key
DRZGHNXLEQHVHB-UHFFFAOYSA-N
Formula
C10H8OS
SMILES
Cc1c(C=O)sc2ccccc12
Molecular Weight1
176.24
CAS
22053-74-3
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Physical Properties

Property Value Unit Source
ω 0.4526 Relay (1.0) Calculated Property
ΔfG° 64.56 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas 4.64 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 79.78 kJ/mol Relay (1.0) Calculated Property
IE 8.35 eV Relay (1.0) Calculated Property
log10WS -3.33 Relay (1.0) Calculated Property
logPoct/wat 3.022 Crippen Calculated Property
McVol 130.760 ml/mol McGowan Calculated Property
Pc 4114.48 kPa Relay (1.0-beta) Calculated Property
Tboil 582.28 K Relay (1.0) Calculated Property
Tc 843.78 K Relay (1.0) Calculated Property
Tfus 364.77 K Relay (1.0) Calculated Property
Vc 0.467 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Benzo[b]thiophene, 2,3-dimethyl. 2-Acetyl-3-methylbenzo[b]thiophene. 2,3,5-trimethyl-benzothiophene. Benzothiophene, 2,3,6-trimethyl. 2,3,4-trimethyl-benzothiophene. Benzothiophene, 2,3,7-trimethyl. Benzo[b]thiophene-2-carboxaldehyde, 7-methyl-. Dibenzothiophene, 1,2,3,4-tetrahydro-. 2-Chlorobenzo[b]thiophene-3-acetonitrile. 3-Methylbenzothiophene. 2-Methyl-4-nonylbenzo[b]thiophene. Naphtho[2,3-b]thiophene, 4,9-dimethyl-. Thianaphthene-3-acetonirile. acenaphtho[4,3-b]benzo[d]thiophene. 4-Methyl-2-nonylbenzo[b]thiophene.

Find more compounds similar to 3-Methylbenzo[b]thiophene-2-carboxaldehyde.

Sources

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