Chemical Properties of 1-(Isocyanatomethyl)-4-(methyloxy)benzene (CAS 56651-60-6)

1-(Isocyanatomethyl)-4-(methyloxy)benzene

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InChI
InChI=1S/C9H9NO2/c1-12-9-4-2-8(3-5-9)6-10-7-11/h2-5H,6H2,1H3
InChI Key
QRBHVARIMDDOOV-UHFFFAOYSA-N
Formula
C9H9NO2
SMILES
COc1ccc(CN=C=O)cc1
Molecular Weight1
163.17
CAS
56651-60-6
Sources

Physical Properties

Property Value Unit Source
Δfgas -141.66 kJ/mol Joback Calculated Property
Δvap 50.51 kJ/mol Joback Calculated Property
logPoct/wat 1.53 Crippen Calculated Property
Pc 3423.86 kPa Joback Calculated Property
Tboil 526.07 K Joback Calculated Property
Tc 742.38 K Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
=C= 1
-N= 1
=CH- (ring) 4
=C< (ring) 2
-CH2- 1
=O 1
-CH3 1

Similar Compounds

N-(4-methoxybenzyl)formamide. 4-Methoxybenzyl isothiocyanate. Benzenemethanamine, 4-methoxy-. Acetamide, N-[(4-methoxyphenyl)methyl]-. N-methyl-p-methoxybenzylamine. p-methoxybenzylidene-benzyl-amine. p-Methoxybenzamide. Benzenemethanamine, 4-butoxy-, hydrochloride (1:1). 4-Methoxybenzoyl isothiocyanate. Benzene, 1-methoxy-4-methyl-. Benzaldehyde, 4-methoxy-. P-trifluoromethoxybenzamide. 3-Methoxybenzylisothiocyanate. Benzene, 1-ethoxy-4-methyl-. N-methyl-p-methoxybenzylidinimine.

Find more compounds similar to 1-(Isocyanatomethyl)-4-(methyloxy)benzene.

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