Chemical Properties of Terephthalonitrile N,N'-dioxide (CAS 3729-34-8)

Terephthalonitrile N,N'-dioxide

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InChI
InChI=1S/C8H4N2O2/c11-9-5-7-1-2-8(4-3-7)6-10-12/h1-4H
InChI Key
JRVRIUGIFUNROE-UHFFFAOYSA-N
Formula
C8H4N2O2
SMILES
[O-][N+]#Cc1ccc(C#[N+][O-])cc1
Molecular Weight1
160.13
CAS
3729-34-8
Other Names
  • 1,4-Dicyanobenzene di-N-oxide
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Physical Properties

Property Value Unit Source
Δcsolid -4057.20 ± 1.50 kJ/mol NIST
Δfgas 410.50 ± 2.70 kJ/mol NIST
Δfsolid 337.50 ± 1.80 kJ/mol NIST
Δsub [73.00; 73.00] kJ/mol Show Hide
Δsub 73.00 ± 2.00 kJ/mol NIST
Δsub 73.00 ± 2.00 kJ/mol NIST
log10WS -8.88 Crippen Calculated Property
logPoct/wat 2.044 Crippen Calculated Property
McVol 114.320 ml/mol McGowan Calculated Property

Similar Compounds

1,4-Benzenedicarbonitrile. Benzonitrile, N-oxide. Benzonitrile. 4-Cyanobenzyl radical. Benzonitrile, 4-(trifluoromethyl)-. Benzonitrile, 4-methyl-. 1,3-Dicyanobenzene. Benzene-1,2,4-tricarbonitrile. Benzonitrile, 4-iodo-. Benzonitrile, 4-bromo-. 1,2-Benzenedicarbonitrile. Benzonitrile, 4-chloro-. Benzonitrile, 4-formyl-. Benzonitrile, 4-fluoro-. Benzonitrile, 4-(chloromethyl)-.

Find more compounds similar to Terephthalonitrile N,N'-dioxide.

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