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CAS No.: | 59690-89-0 |
---|---|
Name: | N-(4-Aminophenyl)propanamide |
Article Data: | 5 |
Molecular Structure: | |
Formula: | C9H12 N2 O |
Molecular Weight: | 164.207 |
Synonyms: | N-(4-Aminophenyl)propanamide;N-(4-Aminophenyl)propionamide; NSC 231666 |
Density: | 1.162 g/cm3 |
Boiling Point: | 282.7 °C at 760 mmHg |
Flash Point: | 124.8 °C |
Hazard Symbols: | Xi |
PSA: | 55.12000 |
LogP: | 2.27150 |
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Molecualr structure of Propanamide,N-(4-aminophenyl)- (CAS NO. 59690-89-0):
IUPAC Name: N-(4-Aminophenyl)propanamide
Molecular Weight: 164.20438 [g/mol]
Molecular Formula: C9H12N2O
XLogP3: 0.9
H-Bond Donor: 2
H-Bond Acceptor: 2
Rotatable Bond Count: 2
Tautomer Count: 2
Exact Mass: 164.094963
MonoIsotopic Mass: 164.094963
Topological Polar Surface Area: 55.1
Heavy Atom Count: 12
Complexity: 151
Index of Refraction: 1.616
Molar Refractivity: 49.39 cm3
Molar Volume: 141.3 cm3
Surface Tension: 50.4 dyne/cm
Density: 1.162 g/cm3
Flash Point: 124.8 °C
Enthalpy of Vaporization: 52.16 kJ/mol
Boiling Point: 282.7 °C at 760 mmHg
Vapour Pressure: 0.0033 mmHg at 25 °C
Canonical SMILES: CCC(=O)NC1=CC=C(C=C1)N
InChI: InChI=1S/C9H12N2O/c1-2-9(12)11-8-5-3-7(10)4-6-8/h3-6H,2,10H2,1H3,(H,11,12)
InChIKey of Propanamide,N-(4-aminophenyl)- (CAS NO. 59690-89-0): MOUFEEIQCXUUMY-UHFFFAOYSA-N
Hazard Codes: Xi
HazardClass: IRRITANT
Propanamide,N-(4-aminophenyl)- (CAS NO. 59690-89-0) is also named as N-(4-aminophenyl)propanamide ; p-Amino propionanilide .