Chemical Properties of Hexane, 1,6-diisocyanato- (CAS 822-06-0)

Hexane, 1,6-diisocyanato-

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InChI
InChI=1S/C8H12N2O2/c11-7-9-5-3-1-2-4-6-10-8-12/h1-6H2
InChI Key
RRAMGCGOFNQTLD-UHFFFAOYSA-N
Formula
C8H12N2O2
SMILES
O=C=NCCCCCCN=C=O
Molecular Weight1
168.19
CAS
822-06-0
Other Names
  • Isocyanic acid, hexamethylene ester
  • Hexamethylene diisocyanate
  • Hexane 1,6-diisocyanate
  • 1,6-Diisocyanatohexane
  • 1,6-Hexamethylene diisocyanate
  • 1,6-Hexylene diisocyanate
  • Hexamethylene 1,6-diisocyanate
  • HMDI
  • Isocyanic acid, diester with 1,6-hexanediol
  • Metyleno-bis-fenyloizocyjanian
  • Szesciometylenodwuizocyjanian
  • TL 78
  • HDI
  • NSC 11687
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Physical Properties

Property Value Unit Source
Δfgas -219.27 kJ/mol Joback Calculated Property
Δvap 52.47 kJ/mol Joback Calculated Property
log10WS -10.17 Crippen Calculated Property
logPoct/wat 1.218 Crippen Calculated Property
McVol 138.080 ml/mol McGowan Calculated Property
Pc 2960.12 kPa Joback Calculated Property
liquid 420.10 J/mol×K NIST
Tboil 515.78 K Joback Calculated Property
Tc 700.81 K Joback Calculated Property
Ttriple 206.06 ± 0.01 K NIST

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,liquid [294.00; 299.20] J/mol×K [298.00; 298.15] Show Hide
Cp,liquid 299.20 J/mol×K 298.00 NIST
Cp,liquid 294.00 J/mol×K 298.15 NIST
Cp,liquid 294.00 J/mol×K 298.15 NIST
ΔfusH [18.64; 18.64] kJ/mol [206.06; 206.10] Show Hide
ΔfusH 18.64 kJ/mol 206.06 NIST
ΔfusH 18.64 kJ/mol 206.06 NIST
ΔfusH 18.64 kJ/mol 206.10 NIST
ΔfusS [90.46; 90.46] J/mol×K [206.06; 206.06] Show Hide
ΔfusS 90.46 J/mol×K 206.06 NIST
ΔfusS 90.46 J/mol×K 206.06 NIST

Similar Compounds

Decamethylene diisocyanate. Hexane, 1-isocyanato-. n-Heptyl isocyanate. Octadecane, 1-isocyanato-. Dodecane, 1-isocyanato-. Octane, 1-isocyanato-. Isothiocyanic acid, hexamethylene ester. 1,8-Octane diisothiocyanate. Hexane, 1-isothiocyanato-. Heptane, 1-isothiocyanato-. Tetradecyl isothiocyanate. Decyl isothiocyanate. Octane, 1-isothiocyanato-. Nonyl isothiocyanate. Undecyl isothiocyanate.

Find more compounds similar to Hexane, 1,6-diisocyanato-.

Sources

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