Chemical Properties of Methanone, bis(4-ethyl-3,5-dimethyl-1H-pyrrol-2-yl)- (CAS 13228-22-3)

Methanone, bis(4-ethyl-3,5-dimethyl-1H-pyrrol-2-yl)-

InChI
InChI=1S/C17H24N2O/c1-7-13-9(3)15(18-11(13)5)17(20)16-10(4)14(8-2)12(6)19-16/h18-19H,7-8H2,1-6H3
InChI Key
NAXHAHJDGRJNSQ-UHFFFAOYSA-N
Formula
C17H24N2O
SMILES
CCc1c(C)[nH]c(C(=O)c2[nH]c(C)c(CC)c2C)c1C
Molecular Weight1
272.39
CAS
13228-22-3
Other Names
  • Ketone, bis(4-ethyl-3,5-dimethylpyrrol-2-yl)
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Physical Properties

Property Value Unit Source
ω 0.7758 Relay (1.0) Calculated Property
ΔcH°solid -9866.00 ± 10.00 kJ/mol NIST
ΔfG° 130.83 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -187.71 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 108.00 kJ/mol Relay (1.0) Calculated Property
IE 7.39 eV Relay (1.0) Calculated Property
log10WS -4.44 Relay (1.0) Calculated Property
logPoct/wat 2.968 Crippen Calculated Property
McVol 233.000 ml/mol McGowan Calculated Property
Pc 1634.09 kPa Relay (1.0-beta) Calculated Property
Tboil 616.63 K Relay (1.0) Calculated Property
Tc 929.44 K Relay (1.0) Calculated Property
Tfus 505.05 K Relay (1.0) Calculated Property
Vc 0.873 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Octaethyl-porphyrin, Si-(OTBDMS)2-derivative. Thymidine, 3'-O-cyclotetramethylene-isopropylsilyl, 5'-O-acetyl. Nalmefene, bis(trifluoroacetate). Zinc octaethylporphyrin chloride. Adenosine, N-(trimethylsilyl)-2',3'-bis-O-(trimethylsilyl)-, 5'-[bis(trimethylsilyl) phosphate]. Retroisosensine. Vobassan-17-oic acid, 4-demethyl-3-oxo-, methyl ester. Retroisosenine. Hydroxy-N-methylcytisine. Thymidine, 3'-O-cyclotetramethylene-tertbutylsilyl, 5'-O-acetyl. Zidovudine. Poligodial + m-Tyr (ethyl ester) adduct (R,S), acetylated, # 1. Poligodial + m-Tyr (ethyl ester) adduct (R,S), acetylated, # 2. Poligodial + m-Tyr (ethyl ester) adduct (R,S). 5-methyluridine, TMS.

Find more compounds similar to Methanone, bis(4-ethyl-3,5-dimethyl-1H-pyrrol-2-yl)-.

Sources

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