Chemical Properties of 1H-Benzimidazol-2-acetonitrile,a-([2-chlorophenyl]methylene)- (CAS 63052-08-4)

1H-Benzimidazol-2-acetonitrile,a-([2-chlorophenyl]methylene)-

InChI
InChI=1S/C16H10ClN3/c17-13-6-2-1-5-11(13)9-12(10-18)16-19-14-7-3-4-8-15(14)20-16/h1-9H,(H,19,20)/b12-9+
InChI Key
BPSIMQTUJJIVOO-FMIVXFBMSA-N
Formula
C16H10ClN3
SMILES
N#CC(=Cc1ccccc1Cl)c1nc2ccccc2[nH]1
Molecular Weight1
279.72
CAS
63052-08-4
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Physical Properties

Property Value Unit Source
ω 0.6099 Relay (1.0) Calculated Property
Δcliquid -8073.40 kJ/mol NIST
Δf 505.02 kJ/mol Relay (1.0-beta) Calculated Property
Δfgas 429.16 kJ/mol Relay (1.0) Calculated Property
Δfliquid 412.80 kJ/mol NIST
Δvap 107.97 kJ/mol Relay (1.0) Calculated Property
IE 8.08 eV Relay (1.0) Calculated Property
log10WS -5.33 Relay (1.0) Calculated Property
logPoct/wat 3.799 Crippen Calculated Property
McVol 202.900 ml/mol McGowan Calculated Property
Pc 3547.97 kPa Relay (1.0-beta) Calculated Property
Tboil 681.59 K Relay (1.0) Calculated Property
Tc 1056.73 K Relay (1.0) Calculated Property
Tfus 510.38 K Relay (1.0) Calculated Property
Vc 0.733 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

1H-Benzimidazole-2-acetonitrile,«alpha»-(phenylmethylene)-. 1H-Benzimidazol-2-acetonitrile,«alpha»([4-nitrophenyl]methylene)-. Aflatoxin G2. Aflatoxin B2. D-Lysergic acid N,N-diethylamide. Lysergic acid N-(methylpropyl)amide. Lysergamide. 2-Dimethylamino-8(ar)-methoxy-tetrahydro-1-acenaphthone. Tinctorine. ethyl eburnamenine-14-carboxylate. Sophoramine. Tetrabenazine M (desmethyl-HO-), monoacetylated. Poligodial + o-Tyr (ethyl ester) adduct (R,S), acetylated, # 2. Poligodial + o-Tyr (ethyl ester) adduct (R,S), acetylated, # 1. norbormide.

Find more compounds similar to 1H-Benzimidazol-2-acetonitrile,a-([2-chlorophenyl]methylene)-.

Sources

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