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CAS No.: | 10288-28-5 |
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Name: | 2-(1-Cyano-1-methylethyl)azocarboxamide |
Molecular Structure: | |
Formula: | C12H16N4O4 |
Molecular Weight: | 140.14 |
Synonyms: | Formamide,1-[(1-cyano-1-methylethyl)azo]- (7CI,8CI); |
EINECS: | 233-638-5 |
Density: | 1.2 g/cm3 |
Melting Point: | 76-78°C |
Boiling Point: | 246.7 °C at 760 mmHg |
Flash Point: | 103 °C |
Solubility: | soluble in water, in ethanol |
Appearance: | pale yellow crystals |
Risk Codes: | 2017/11/22 |
Safety: | 16-24/25-36/37/39 |
PSA: | 91.60000 |
LogP: | 1.51978 |
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IUPAC Name: 2-Cyanopropan-2-yliminourea
Synonyms of 2-(1-Cyano-1-methylethyl)azocarboxamide (CAS NO.10288-28-5): (1-Cyano-1-methyl-ethyl)iminourea
CAS NO: 10288-28-5
Molecular Formula: C12H16N4O4
Molecular Weight: 140.14
Molecular Structure:
EINECS: 233-638-5
H bond acceptors: 5
H bond donors: 2
Freely Rotating Bonds: 2
Polar Surface Area: 91.6 Å2
Index of Refraction: 1.538
Molar Refractivity: 36.53 cm3
Molar Volume: 116.7 cm3
Surface Tension: 47.6 dyne/cm
Density: 1.2 g/cm3
Flash Point: 103 °C
Enthalpy of Vaporization: 48.38 kJ/mol
Boiling Point: 246.7 °C at 760 mmHg
Vapour Pressure: 0.0267 mmHg at 25°C
SMILES: CC(C)(C#N)/N=N/C(N)=O
InChI: InChI=1/C5H8N4O/c1-5(2,3-6)9-8-4(7)10/h1-2H3,(H2,7,10)
InChIKey: CKSAKVMRQYOFBC-UHFFFAOYAF
Std. InChI: InChI=1S/C5H8N4O/c1-5(2,3-6)9-8-4(7)10/h1-2H3,(H2,7,10)
Std. InChIKey: CKSAKVMRQYOFBC-UHFFFAOYSA-N
Product Categories of 2-(1-Cyano-1-methylethyl)azocarboxamide (CAS NO.10288-28-5): pharmacetical