Chemical Properties of 7-ethyl-1,5,7-triazabicyclo[4.4.0]dec-5-ene (ETBD) (CAS 95510-44-4)

7-ethyl-1,5,7-triazabicyclo[4.4.0]dec-5-ene (ETBD)

InChI
InChI=1S/C9H17N3/c1-2-11-7-4-8-12-6-3-5-10-9(11)12/h2-8H2,1H3
InChI Key
AAPJUEKLMYSSCH-UHFFFAOYSA-N
Formula
C9H17N3
SMILES
CCN1CCCN2CCCN=C12
Molecular Weight1
167.25
CAS
95510-44-4
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Physical Properties

Property Value Unit Source
ω 0.4645 Relay (1.0) Calculated Property
PAff 1068.20 kJ/mol NIST
BasG 1035.80 kJ/mol NIST
ΔfG° 326.43 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas 24.98 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 65.62 kJ/mol Relay (1.0) Calculated Property
IE 7.71 eV Relay (1.0) Calculated Property
log10WS -0.72 Relay (1.0) Calculated Property
logPoct/wat 0.774 Crippen Calculated Property
McVol 141.590 ml/mol McGowan Calculated Property
Pc 2998.41 kPa Relay (1.0-beta) Calculated Property
Tboil 561.01 K Relay (1.0) Calculated Property
Tc 779.56 K Relay (1.0) Calculated Property
Tfus 282.99 K Relay (1.0) Calculated Property
Vc 0.503 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

2H-Pyrimido[1,2-a]pyrimidine, 1,3,4,6,7,8-hexahydro-1-methyl-. 7-isopropyl-1,5,7-triazabicyclo[4.4.0]dec-5-ene (ITBD). 2H-Pyrimido[1,2-a]pyrimidine, 1,3,4,6,7,8-hexahydro-. 1,5-Diazabicyclo[4.3.0]non-5-ene. Pyrimido[1,2-a]azepine, 2,3,4,6,7,8,9,10-octahydro-. Formamidine, 1-butyl-3,3-hexamethyleno. Formamidine, 3,3-hexamethyleno-1-pentyl. Formamidine, 1-hexyl-3,3-hexamethyleno. Formamidine, 3,3-hexamethyleno-1-propyl. Methanimine, 1-(1-piperidinyl), N-butyl. Methanimine, 1-(1-piperidinyl), N-pentyl. Methanimine, 1-(1-piperidinyl), N-propyl. Methanimine, 1-(1-piperidinyl), N-hexyl. Formamidine, 1-isobutyl-3,3-hexamethyleno. Benzoic acid, 4-(1-trimethylsilyloxy)-2-(pyrrolidin-1-yl)butyl-, trimethylsilyl ester.

Find more compounds similar to 7-ethyl-1,5,7-triazabicyclo[4.4.0]dec-5-ene (ETBD).

Sources

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