Chemical Properties of Dibenzosuberone (CAS 1210-35-1)

Dibenzosuberone

InChI
InChI=1S/C15H12O/c16-15-13-7-3-1-5-11(13)9-10-12-6-2-4-8-14(12)15/h1-8H,9-10H2
InChI Key
BMVWCPGVLSILMU-UHFFFAOYSA-N
Formula
C15H12O
SMILES
O=C1c2ccccc2CCc2ccccc21
Molecular Weight1
208.26
CAS
1210-35-1
Other Names
  • 10,11-Dihydro-5H-dibenzo(a,d)cyclohepten-5-one
  • 10,11-Dihydrodibenzo[a,d]cyclohepten-5-one
  • 2,3:6,7-Dibenzosuberone
  • 5-Dibenzosuberone
  • 5H-Dibenzo[a,d]cyclohepten-5-one, 10,11-dihydro-
  • Dibenzo[a,d]cyclohepta[1,4]dien-5-one
  • Dibenzo[a,d]cycloheptadien-5-one
  • Dibenzocycloheptadienone
  • Dibenzocycloheptenone
  • Dibenzosuberan-5-one
  • NSC 49727
  • dibenzo(b,f)cycloheptan-1-one
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Physical Properties

Property Value Unit Source
ω 0.5400 Relay (1.0) Calculated Property
ΔcH°solid -7496.00 ± 3.40 kJ/mol NIST
ΔfG° 226.85 kJ/mol Joback Calculated Property
ΔfH°gas 42.38 kJ/mol Relay (1.0) Calculated Property
ΔfH°solid -123.50 ± 3.40 kJ/mol NIST
ΔfusH° 18.48 kJ/mol Joback Calculated Property
ΔsubH° 109.30 kJ/mol NIST
ΔvapH° 95.21 kJ/mol Relay (1.0) Calculated Property
IE 8.80 eV Relay (1.0) Calculated Property
log10WS -5.13 Relay (1.0) Calculated Property
logPoct/wat 3.016 Crippen Calculated Property
McVol 165.400 ml/mol McGowan Calculated Property
Pc 2992.59 kPa Joback Calculated Property
Tboil 637.98 K Relay (1.0) Calculated Property
Tc 912.60 K Relay (1.0) Calculated Property
Tfus 424.21 K Relay (1.0) Calculated Property
Vc 0.601 m3/kmol Relay (1.0) Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
ΔfusH 17.15 kJ/mol 305.50 NIST
ΔvapH 90.00 ± 1.50 kJ/mol 326.00 NIST

Pressure Dependent Properties

Property Value Unit Pressure (kPa) Source
Tboilr 421.20 K 0.04 NIST

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [194.94; 522.27] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-6.97100e+01
Coefficient B1.16110e+00
Coefficient C-7.52120e-04
Coefficient D1.83000e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 194.94 J/mol×K 273.00 Calculated Property
Cp,gas 255.03 J/mol×K 353.78 Calculated Property
Cp,gas 307.84 J/mol×K 434.56 Calculated Property
Cp,gas 353.95 J/mol×K 515.33 Calculated Property
Cp,gas 393.93 J/mol×K 596.11 Calculated Property
Cp,gas 428.38 J/mol×K 676.89 Calculated Property
Cp,gas 457.85 J/mol×K 757.67 Calculated Property
Cp,gas 482.94 J/mol×K 838.44 Calculated Property
Cp,gas 504.22 J/mol×K 919.22 Calculated Property
Cp,gas 522.27 J/mol×K 1000.00 Calculated Property

Similar Compounds

10,11-Dihydro-5H-dibenzo(a,d)cycloheptene. Noxiptiline. 5-Phenyl-10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-ol. Cyheptamide. 5-chloro-2-(2-propinyl)benzophenone (CPB). 5-(4-Chlorophenyl)-10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-ol. 5-(4-Methoxyphenyl)-10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-ol. 5H-Dibenzo[a,d]cyclohepten-5-ol, 10,11-dihydro-. Formamide, n-(10,11-dihydro-5h-dibenzo(a,d)-cyclohepten-5-yl)-. Amitriptyline. Hydroxyamitryptyline. Amitriptylinoxide. Anthracene photodimer. Nortriptyline M(HO). Nortriptyline M(di-HO).

Find more compounds similar to Dibenzosuberone.

Sources

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