Chemical Properties of Cycloheptatrienyl radical (CAS 3551-27-7)

Cycloheptatrienyl radical

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InChI
InChI=1S/C7H7/c1-2-4-6-7-5-3-1/h1-7H
InChI Key
WIQYRPSOJMHAHR-UHFFFAOYSA-N
Formula
C7H7
SMILES
[CH]1C=CC=CC=C1
Molecular Weight1
91.13
CAS
3551-27-7

Physical Properties

Property Value Unit Source
PAff 832.40 kJ/mol NIST
BasG 800.00 kJ/mol NIST
EA [0.39; 0.49] eV Show Hide
EA 0.39 ± 0.04 eV NIST
EA 0.49 ± 0.13 eV NIST
Δf 162.67 kJ/mol Joback Calculated Property
Δfgas 89.50 kJ/mol Joback Calculated Property
Δfus 8.97 kJ/mol Joback Calculated Property
Δvap 32.51 kJ/mol Joback Calculated Property
IE [6.24; 6.74] eV Show Hide
IE 6.28 ± 0.02 eV NIST
IE 6.74 ± 0.05 eV NIST
IE 6.24 ± 0.01 eV NIST
IE 6.24 ± 0.01 eV NIST
IE 6.60 ± 0.10 eV NIST
log10WS -1.82 Crippen Calculated Property
logPoct/wat 1.873 Crippen Calculated Property
McVol 83.580 ml/mol McGowan Calculated Property
Pc 4397.41 kPa Joback Calculated Property
Tboil 380.16 K Joback Calculated Property
Tc 594.48 K Joback Calculated Property
Tfus 191.16 K Joback Calculated Property
Vc 0.301 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [129.53; 192.76] J/mol×K [380.16; 594.48] Show Hide
Cp,gas 129.53 J/mol×K 380.16 Joback Calculated Property
Cp,gas 142.11 J/mol×K 415.88 Joback Calculated Property
Cp,gas 153.81 J/mol×K 451.60 Joback Calculated Property
Cp,gas 164.68 J/mol×K 487.32 Joback Calculated Property
Cp,gas 174.76 J/mol×K 523.04 Joback Calculated Property
Cp,gas 184.10 J/mol×K 558.76 Joback Calculated Property
Cp,gas 192.76 J/mol×K 594.48 Joback Calculated Property
η [0.0002852; 0.0012422] Pa×s [191.16; 380.16] Show Hide
η 0.0012422 Pa×s 191.16 Joback Calculated Property
η 0.0008172 Pa×s 222.66 Joback Calculated Property
η 0.0005964 Pa×s 254.16 Joback Calculated Property
η 0.0004666 Pa×s 285.66 Joback Calculated Property
η 0.0003833 Pa×s 317.16 Joback Calculated Property
η 0.0003262 Pa×s 348.66 Joback Calculated Property
η 0.0002852 Pa×s 380.16 Joback Calculated Property

Similar Compounds

1,3,5-Cycloheptatriene. 1,3,6-Cyclooctatriene. (Z,E,E)-2,4,6-nonatriene. Cyclopentadienyl radical. (E,E)-1,3-(Z)-5-Octatriene. fucoserratene. 1,3-trans,5-cis-Octatriene. 1,3-cis,5-cis-Octatriene. 1,3,5-Octatriene. 2,4,6-Cycloheptatriene-1-carbonitrile. 1,3,6-Heptatriene. 1,3,6-Octatriene, (E,E)-. 1,3,6-Octatriene. 1,3,6-Octatriene, E,Z. 1,3,5,8-Undecatetraene.

Find more compounds similar to Cycloheptatrienyl radical.

Sources

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