Chemical Properties of 2,3-Dihydro-4-methyl-1H-1,5-benzodiazepin-2-one (CAS 6276-48-8)

2,3-Dihydro-4-methyl-1H-1,5-benzodiazepin-2-one

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InChI
InChI=1S/C10H10N2O/c1-7-6-10(13)12-9-5-3-2-4-8(9)11-7/h2-5H,6H2,1H3,(H,12,13)
InChI Key
AFHSLLLKMSITIA-UHFFFAOYSA-N
Formula
C10H10N2O
SMILES
CC1=Nc2ccccc2N=C(O)C1
Molecular Weight1
174.20
CAS
6276-48-8
Other Names
  • 1,3-dihydro-4-methyl-2H-1,5-benzodiazepin-2-one
  • 2H-1,5-Benzodiazepin-2-one, 1,3-dihydro-4-methyl-
  • 4-Methyl-1,5-benzo-diazepin-2-one
Sources

Physical Properties

Property Value Unit Source
Δf 317.76 kJ/mol Joback Calculated Property
Δfgas 138.48 kJ/mol Joback Calculated Property
Δfus 24.20 kJ/mol Joback Calculated Property
Δvap 72.37 kJ/mol Joback Calculated Property
logPoct/wat 2.77 Crippen Calculated Property
Pc 4368.40 kPa Joback Calculated Property
Tboil 687.67 K Joback Calculated Property
Tc 929.40 K Joback Calculated Property
Tfus 487.00 K Joback Calculated Property
Vc 0.52 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 375.21 J/mol×K 687.67 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

cyclopropanecarboxamide, N-phenyl. Butanamide, 3-methyl-N-phenyl-. N,N'-(4-Chloro-1,2-phenylene)bis(2,2,3,3,3-pentafluoropropanamide). M-chlorobutyrylanilide. Butanamide, N-(3-chlorophenyl)-. Butanamide, N-(3-methylphenyl)-. Hexanamide, N-(3-chlorophenyl)-. Cyclohexanecarboxanilide. Pentanamide, N-(3-methylphenyl)-. Cyclobutanecarboxamide, N-(3-chlorophenyl)-. Pentanamide, N-(3-methylphenyl)-5-chloro-. Butanamide, N-(2-methylphenyl)-3-oxo-. Octanamide, N-(3-methylphenyl)-. 3',4'-Dichloropelargoanilide. Butanamide, N-(2-methoxyphenyl)-3-oxo-.

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