Chemical Properties of 1-Chloro-4-(2-isocyanatoethyl)benzene (CAS 55121-08-9)

1-Chloro-4-(2-isocyanatoethyl)benzene

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InChI
InChI=1S/C9H8ClNO/c10-9-3-1-8(2-4-9)5-6-11-7-12/h1-4H,5-6H2
InChI Key
UFGOQTFPJKUOBH-UHFFFAOYSA-N
Formula
C9H8ClNO
SMILES
O=C=NCCc1ccc(Cl)cc1
Molecular Weight1
181.62
CAS
55121-08-9
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Physical Properties

Property Value Unit Source
Δfgas -25.18 kJ/mol Joback Calculated Property
Δvap 52.48 kJ/mol Joback Calculated Property
log10WS -6.88 Crippen Calculated Property
logPoct/wat 2.218 Crippen Calculated Property
McVol 133.400 ml/mol McGowan Calculated Property
Pc 3345.11 kPa Joback Calculated Property
Inp [1381.30; 1381.30]   Show Hide
Inp 1381.30 NIST
Inp 1381.30 NIST
Tboil 541.08 K Joback Calculated Property
Tc 764.62 K Joback Calculated Property

Similar Compounds

2-(4-Chlorophenethyl) isothiocyanate. (2-Isocyanatoethyl)benzene. Benzene, (2-isothiocyanatoethyl)-. 4-Methylphenethyl isothiocyanate. Benzene, 1-chloro-4-ethyl-. 4-(2-Isothiocyanatoethyl)phenol. 2-(3-Chlorophenyl)ethylamine. 2-Phenethylamine, N-dimethylaminomethylene-. Methyl phenethylcarbamate. Acetamide, N-(2-phenylethyl)-. 2,4-Dichlorophenethylamine. Benzene, 1-(2-bromoethyl)-4-chloro-. 2-(p-Tolyl)ethylamine. Benzeneethanamine. Benzene, 1-chloro-4-(2-fluoroethyl).

Find more compounds similar to 1-Chloro-4-(2-isocyanatoethyl)benzene.

Sources

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