Chemical Properties of 1H-Indole, 2-methyl- (CAS 95-20-5)

1H-Indole, 2-methyl-

PDF Excel Molecule Calculator
InChI
InChI=1S/C9H9N/c1-7-6-8-4-2-3-5-9(8)10-7/h2-6,10H,1H3
InChI Key
BHNHHSOHWZKFOX-UHFFFAOYSA-N
Formula
C9H9N
SMILES
Cc1cc2ccccc2[nH]1
Molecular Weight1
131.17
CAS
95-20-5
Other Names
  • 2-Methyl-1H-indole
  • 2-Methylindole
  • Indole, 2-methyl-
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
Δsub 88.70 ± 2.40 kJ/mol NIST
IE [7.44; 7.67] eV Show Hide
IE 7.67 ± 0.00 eV NIST
IE 7.67 ± 0.00 eV NIST
IE 7.44 ± 0.01 eV NIST
log10WS -2.97 Crippen Calculated Property
logPoct/wat 1.994 Crippen Calculated Property
McVol 108.730 ml/mol McGowan Calculated Property
Inp [234.59; 1400.00]   Show Hide
Inp 1385.00 NIST
Inp 1400.00 NIST
Inp 1373.00 NIST
Inp 234.59 NIST
Inp 240.10 NIST
Inp 237.42 NIST
Inp 1373.00 NIST
I 2425.00 NIST
Tboil [543.00; 545.20] K Show Hide
Tboil 545.20 K NIST
Tboil 543.00 ± 4.00 K NIST
Ttriple 331.97 K Thermod...

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
ΔfusH 15.72 kJ/mol 329.40 NIST

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.64] kPa [409.32; 578.57] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.47095e+01
Coefficient B-4.56624e+03
Coefficient C-9.27020e+01
Temperature range, min.409.32
Temperature range, max.578.57
Pvap 1.33 kPa 409.32 Calculated Property
Pvap 2.99 kPa 428.13 Calculated Property
Pvap 6.16 kPa 446.93 Calculated Property
Pvap 11.81 kPa 465.74 Calculated Property
Pvap 21.25 kPa 484.54 Calculated Property
Pvap 36.23 kPa 503.35 Calculated Property
Pvap 58.96 kPa 522.15 Calculated Property
Pvap 92.10 kPa 540.96 Calculated Property
Pvap 138.80 kPa 559.76 Calculated Property
Pvap 202.64 kPa 578.57 Calculated Property

Similar Compounds

1H-Indole, 2,5-dimethyl-. 1H-Indole, 2,6-dimethyl-. 2,4-Dimethyl-1H-indole. 1H-Indole, 2,3-dimethyl-. 4-Hydroxymethyl-2-methyl-1H-indole. Indole-2-carboxylic acid. 1H-Indole, 1,2-dimethyl-. 1H-Indole, 2-(1,1-dimethylethyl)-. 4-Methoxymethyl-2-methyl-1H-indole. Quinoline, 2,6-dimethyl-. 1H-Indole, 4-methyl-. 4-Methylcarbazole. 1H-Indole, 5-methyl-. 1H-Indole, 2,3,5-trimethyl-. Indole, 3-methyl-.

Find more compounds similar to 1H-Indole, 2-methyl-.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.