Chemical Properties of Ethanone, 1-(2-thienyl)- (CAS 88-15-3)

Ethanone, 1-(2-thienyl)-

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InChI
InChI=1S/C6H6OS/c1-5(7)6-3-2-4-8-6/h2-4H,1H3
InChI Key
WYJOVVXUZNRJQY-UHFFFAOYSA-N
Formula
C6H6OS
SMILES
CC(=O)c1cccs1
Molecular Weight1
126.18
CAS
88-15-3
Other Names
  • 1-(2-Thienyl)ethanone
  • 2-ACETOTHIOPHENE
  • 2-Acethylthiophene
  • 2-Acetothienone
  • 2-Acetylthiophen
  • 2-Acetylthiophene
  • 2-Thienyl methyl ketone
  • Ketone, methyl 2-thienyl
  • METHYL 2-THIENYL KETONE
  • NSC 2345
  • thiophene, 2-acetyl-
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Physical Properties

Property Value Unit Source
Cp,liquid [205.70; 210.72] J/mol×K Show Hide
Cp,liquid 205.70 J/mol×K Thermop...
Cp,liquid 210.72 J/mol×K Enthalp...
Δvap 58.80 ± 1.20 kJ/mol NIST
IE 9.20 ± 0.05 eV NIST
log10WS -1.89 Crippen Calculated Property
logPoct/wat 1.951 Crippen Calculated Property
McVol 93.860 ml/mol McGowan Calculated Property
Inp [1041.00; 1121.00]   Show Hide
Inp 1061.00 NIST
Inp 1058.00 NIST
Inp 1060.00 NIST
Inp 1084.00 NIST
Inp 1084.00 NIST
Inp 1051.00 NIST
Inp 1051.00 NIST
Inp 1085.00 NIST
Inp Outlier 1121.00 NIST
Inp 1112.00 NIST
Inp 1053.00 NIST
Inp 1092.00 NIST
Inp 1092.00 NIST
Inp Outlier 1116.00 NIST
Inp 1090.00 NIST
Inp 1055.00 NIST
Inp 1060.00 NIST
Inp 1069.00 NIST
Inp 1052.00 NIST
Inp 1058.00 NIST
Inp 1050.00 NIST
Inp 1049.00 NIST
Inp 1052.00 NIST
Inp 1085.00 NIST
Inp 1101.00 NIST
Inp 1107.00 NIST
Inp 1090.00 NIST
Inp 1090.00 NIST
Inp 1090.00 NIST
Inp 1086.00 NIST
Inp 1067.00 NIST
Inp 1066.00 NIST
Inp 1041.00 NIST
Inp 1043.00 NIST
Inp 1049.00 NIST
Inp 1095.00 NIST
Inp 1051.00 NIST
Inp 1069.00 NIST
Inp 1058.00 NIST
Inp 1061.00 NIST
I [1725.00; 1785.00]   Show Hide
I 1731.00 NIST
I 1763.00 NIST
I 1769.00 NIST
I 1785.00 NIST
I 1782.00 NIST
I 1782.00 NIST
I 1735.00 NIST
I 1777.00 NIST
I 1777.00 NIST
I 1771.00 NIST
I 1773.00 NIST
I 1740.00 NIST
I 1740.00 NIST
I 1762.00 NIST
I 1725.00 NIST
I 1760.00 NIST
I 1771.00 NIST
Tboil [486.50; 505.05] K Show Hide
Tboil 505.05 K KDB
Tboil 486.70 K NIST
Tboil 486.50 ± 0.50 K NIST
Tfus [282.00; 283.60] K Show Hide
Tfus 282.00 K NIST
Tfus 283.60 ± 0.02 K NIST

Pressure Dependent Properties

Property Value Unit Pressure (kPa) Source
Tboilr [368.20; 368.60] K [1.70; 1.70] Show Hide
Tboilr 368.20 K 1.70 NIST
Tboilr 368.60 ± 1.00 K 1.70 NIST

Datasets

Mass density, kg/m3

Fixed Measured
Pressure, kPa - Liquid Temperature, K - Liquid Mass density, kg/m3 - Liquid
100.00 283.15 1180.61
100.00 288.15 1175.97
100.00 293.15 1171.0
100.00 298.15 1166.24
100.00 303.15 1161.59
100.00 308.15 1156.84
100.00 313.15 1152.05
100.00 318.15 1147.15
100.00 323.15 1142.34
100.00 328.15 1137.56
100.00 333.15 1132.76
100.00 338.15 1127.97
2000.00 283.15 1181.78
2000.00 288.15 1177.04
2000.00 293.15 1172.28
2000.00 298.15 1167.52
2000.00 303.15 1162.77
2000.00 308.15 1158.03
2000.00 313.15 1153.3
2000.00 318.15 1148.56
2000.00 323.15 1143.79
2000.00 328.15 1139.02
2000.00 333.15 1134.24
2000.00 338.15 1129.47
5000.00 283.15 1183.44
5000.00 288.15 1178.73
5000.00 293.15 1174.02
5000.00 298.15 1169.28
5000.00 303.15 1164.6
5000.00 308.15 1159.89
5000.00 313.15 1155.19
5000.00 318.15 1150.49
5000.00 323.15 1145.78
5000.00 328.15 1141.06
5000.00 333.15 1136.33
5000.00 338.15 1131.61
7000.00 283.15 1184.54
7000.00 288.15 1179.85
7000.00 293.15 1175.16
7000.00 298.15 1170.46
7000.00 303.15 1165.79
7000.00 308.15 1161.11
7000.00 313.15 1156.45
7000.00 318.15 1151.77
7000.00 323.15 1147.09
7000.00 328.15 1142.39
7000.00 333.15 1137.7
7000.00 338.15 1133.01
10000.00 283.15 1186.17
10000.00 288.15 1181.52
10000.00 293.15 1176.85
10000.00 298.15 1172.2
10000.00 303.15 1167.56
10000.00 308.15 1162.92
10000.00 313.15 1158.29
10000.00 318.15 1153.65
10000.00 323.15 1149.02
10000.00 328.15 1144.38
10000.00 333.15 1139.72
10000.00 338.15 1135.08
15000.00 283.15 1188.81
15000.00 288.15 1184.21
15000.00 293.15 1179.61
15000.00 298.15 1175.02
15000.00 303.15 1170.45
15000.00 308.15 1165.87
15000.00 313.15 1161.33
15000.00 318.15 1156.74
15000.00 323.15 1152.17
15000.00 328.15 1147.6
15000.00 333.15 1143.11
15000.00 338.15 1138.55
20000.00 283.15 1191.4
20000.00 288.15 1186.85
20000.00 293.15 1182.3
20000.00 298.15 1177.77
20000.00 303.15 1173.26
20000.00 308.15 1168.75
20000.00 313.15 1164.23
20000.00 318.15 1159.72
20000.00 323.15 1155.23
20000.00 328.15 1150.78
20000.00 333.15 1146.25
20000.00 338.15 1141.78
25000.00 283.15 1193.92
25000.00 288.15 1189.43
25000.00 293.15 1184.93
25000.00 298.15 1180.44
25000.00 303.15 1175.98
25000.00 308.15 1171.53
25000.00 313.15 1167.08
25000.00 318.15 1162.64
25000.00 323.15 1158.22
25000.00 328.15 1153.79
25000.00 333.15 1149.39
25000.00 338.15 1144.86
30000.00 283.15 1196.37
30000.00 288.15 1191.93
30000.00 293.15 1187.48
30000.00 298.15 1183.06
30000.00 303.15 1178.65
30000.00 308.15 1174.24
30000.00 313.15 1169.85
30000.00 318.15 1165.47
30000.00 323.15 1161.08
30000.00 328.15 1156.77
30000.00 333.15 1152.35
30000.00 338.15 1147.94
35000.00 283.15 1198.77
35000.00 288.15 1194.37
35000.00 293.15 1189.98
35000.00 298.15 1185.59
35000.00 303.15 1181.25
35000.00 308.15 1176.89
35000.00 313.15 1172.56
35000.00 318.15 1168.21
35000.00 323.15 1163.89
35000.00 328.15 1159.56
35000.00 333.15 1155.23
35000.00 338.15 1150.94
40000.00 283.15 1201.11
40000.00 288.15 1196.76
40000.00 293.15 1192.41
40000.00 298.15 1188.08
40000.00 303.15 1183.77
40000.00 308.15 1179.46
40000.00 313.15 1175.19
40000.00 318.15 1170.9
40000.00 323.15 1166.63
40000.00 328.15 1162.34
40000.00 333.15 1158.08
40000.00 338.15 1153.82
45000.00 283.15 1203.39
45000.00 288.15 1199.09
45000.00 293.15 1194.78
45000.00 298.15 1190.5
45000.00 303.15 1186.24
45000.00 308.15 1181.98
45000.00 313.15 1177.74
45000.00 318.15 1173.5
45000.00 323.15 1169.28
45000.00 328.15 1165.07
45000.00 333.15 1160.83
45000.00 338.15 1156.64
50000.00 293.15 1197.1
50000.00 298.15 1192.87
50000.00 303.15 1188.64
50000.00 308.15 1184.43
50000.00 313.15 1180.24
50000.00 318.15 1176.04
50000.00 323.15 1171.88
50000.00 328.15 1167.69
50000.00 333.15 1163.52
50000.00 338.15 1159.38
55000.00 293.15 1199.35
55000.00 298.15 1195.17
55000.00 303.15 1190.99
55000.00 308.15 1186.82
55000.00 313.15 1182.67
55000.00 318.15 1178.53
55000.00 323.15 1174.4
55000.00 328.15 1170.28
55000.00 333.15 1166.14
55000.00 338.15 1162.04
60000.00 293.15 1201.56
60000.00 298.15 1197.42
60000.00 303.15 1193.27
60000.00 308.15 1189.15
60000.00 313.15 1185.04
60000.00 318.15 1180.93
60000.00 323.15 1176.86
60000.00 328.15 1172.79
60000.00 333.15 1168.68
60000.00 338.15 1164.64
65000.00 293.15 1203.71
65000.00 298.15 1199.61
65000.00 303.15 1195.5
65000.00 308.15 1191.41
65000.00 313.15 1187.36
65000.00 318.15 1183.29
65000.00 323.15 1179.25
65000.00 328.15 1175.21
65000.00 333.15 1171.17
65000.00 338.15 1167.11
Reference

Similar Compounds

2-Thenoylacetonitrile. 1-(2-Thienyl)-1-propanone. Ethanone,2,2,2-trifluoro-1-(2-thienyl)-. 2-Acetyl-5-bromothiophene. 2-Acetyl-5-chlorothiophene. 1,3-Butanedione, 1-(2-thienyl)-. 2-Acetyl-5-cyanothiophene. 1-Butanone, 1-(2-thienyl)-. 1,3-Butanedione, 4,4,4-trifluoro-1-(2-thienyl)-. Thiophene, 2-(1,1-dimethylethyl)-. 2-Acetyl-5-methylthiophene. Ethanone, 1-(4-methyl-2-thienyl)-. Thiophene, 2-pentanoyl. «gamma»-Chloro-2-butyrothienone. Thiophene, 2-ethyl-.

Find more compounds similar to Ethanone, 1-(2-thienyl)-.

Sources

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.