Chemical Properties of 4,4'-Biphenyldiisocyanate (CAS 2761-22-0)

4,4'-Biphenyldiisocyanate

InChI
InChI=1S/C14H8N2O2/c17-9-15-13-5-1-11(2-6-13)12-3-7-14(8-4-12)16-10-18/h1-8H
InChI Key
RQBUVIFBALZGPC-UHFFFAOYSA-N
Formula
C14H8N2O2
SMILES
O=C=Nc1ccc(-c2ccc(N=C=O)cc2)cc1
Molecular Weight1
236.23
CAS
2761-22-0
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Physical Properties

Property Value Unit Source
ΔcH°solid -6602.40 ± 4.20 kJ/mol NIST
ΔfH°gas 100.58 kJ/mol Relay (1.0) Calculated Property
ΔfH°solid -50.20 ± 4.20 kJ/mol NIST
ΔvapH° 86.40 kJ/mol Relay (1.0) Calculated Property
IE 8.35 eV Relay (1.0) Calculated Property
logPoct/wat 3.288 Crippen Calculated Property
McVol 175.100 ml/mol McGowan Calculated Property
Pc 3149.09 kPa Joback Calculated Property
Tc 868.22 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Similar Compounds

Benzidine. [1,1'-Biphenyl]-4-amine. 4,4'-Diamino-p-terphenyl. 1,1'-Biphenyl, 4-nitro-. 1,1'-Biphenyl, 4,4'-dinitro-. 2-Biphenylisothiocyanate. Diazene, [1,1'-biphenyl]-4-ylphenyl-. 1,1':4',1''-Terphenyl, 4-nitro-. [1,1'-Biphenyl]-3-amine. Benzenamine, 4-(4-nitrophenyl)-. [1,1'-Biphenyl]-4,4'-diamine, N,N'-diphenyl-. [1,1'-Biphenyl]-4,4'-diamine, N,N,N',N'-tetramethyl-. P-phenylenediamine, n,n'-bis(p-biphenylyl)-. 2-Aminobiphenyl. [1,1'-Biphenyl]-2,2'-diamine.

Find more compounds similar to 4,4'-Biphenyldiisocyanate.

Sources

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