Chemical Properties of 3H-Pyrazol-3-one, 2,4-dihydro-2,5-dimethyl- (CAS 2749-59-9)

3H-Pyrazol-3-one, 2,4-dihydro-2,5-dimethyl-

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InChI
InChI=1S/C5H8N2O/c1-4-3-5(8)7(2)6-4/h3H2,1-2H3
InChI Key
NDELSWXIAJLWOU-UHFFFAOYSA-N
Formula
C5H8N2O
SMILES
CC1=NN(C)C(=O)C1
Molecular Weight1
112.13
CAS
2749-59-9
Other Names
  • 2-Pyrazolin-5-one, 1,3-dimethyl-
  • 1,3-Dimethyl-5-pyrazolinone
  • 1,3-Dimethyl-5-pyrazolone
  • 2,4-dihydro-2,5-dimethyl-3H-pyrazol-3-one
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Physical Properties

Property Value Unit Source
ω 0.4268 Relay (... Calculated Property
ΔfG° 56.93 kJ/mol Relay (... Calculated Property ⚠️
ΔfH°gas -1.97 kJ/mol Relay (... Calculated Property
ΔvapH° 58.06 kJ/mol Relay (... Calculated Property
IE 8.65 ± 0.05 eV NIST
log10WS 0.62 Relay (... Calculated Property
logPoct/wat 0.224 Crippen Calculated Property
McVol 87.680 ml/mol McGowan Calculated Property
Pc 4515.28 kPa Relay (... Calculated Property ⚠️
Tboil 468.00 K Relay (... Calculated Property
Tc 703.48 K Relay (... Calculated Property
Tfus 353.23 K Relay (... Calculated Property
Vc 0.332 m3/kmol Relay (... Calculated Property

Similar Compounds

1-Methyl-3-trifluoromethyl-2-pyrazolin-5-one. 1-Methyl-3-n-propyl-2-pyrazolin-5-one. 2-Pyrazoline, 1,3,5-trimethyl. 2-Pyrazoline, 1-ethyl-3-methyl. 2-Pyrazoline, 1-isobutyl-3-methyl-. 3H-Pyrazol-3-one, 2,4-dihydro-2-methyl-5-phenyl-. 3H-Pyrazol-3-one, 2,4-dihydro-5-methyl-2-phenyl-. 2-Pyrazolin-5-one, 3-isobutyl-. 4,5,6,7-Tetrahydropyrazolo[1,5-d][1,2,4]-triazin-4-one, 2,5,6-trimethyl. 4,5,6,7-Tetrahydropyrazolo[1,5-d][1,2,4]-triazin-4-one, 2,5-dimethyl. 1-(3-Chlorophenyl)-3-methyl-2-pyrazolin-5-one. 2-Pyrazoline, 3-butyl-5,5-dimethyl, N-acetyl. 1-Acetyl-4,5-dihydro-1H-pyrazole. 4,5,6,7-Tetrahydropyrazolo[1,5-d][1,2,4]-triazin-4-one, 2,6-dimethyl. 2-Pyrazoline, 5-ethyl-3,5-dimethyl, N-acetyl.

Find more compounds similar to 3H-Pyrazol-3-one, 2,4-dihydro-2,5-dimethyl-.

Sources

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