4-Bromo-3-oxo-N-phenylbutanamide supplier

Name
4-Bromo-3-oxo-N-phenylbutanamide
EINECS
CAS No. 1205-74-9
Article Data9
CAS DataBase
Density 1.544 g/cm³
Solubility
Melting Point
Formula C₁₀H₁₀BrNO₂
Boiling Point 437.3 °C at 760 mmHg
Molecular Weight 256.099
Flash Point 218.3 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Acetoacetanilide,4-bromo- (7CI,8CI);4-Bromo-3-oxo-N-phenylbutanamide;4-Bromo-3-oxobutyranilide;4-Bromoacetoacetanilide;NSC 108424;g-Bromoacetoacetanilide;w-Bromoacetoacetanilide;
PSA 46.17000
LogP 2.05220

4-Bromo-3-oxo-N-phenylbutanamide Specification

The 4-Bromo-3-oxo-N-phenylbutanamide with the CAS number 1205-74-9 is also called Butanamide,4-bromo-3-oxo-N-phenyl-. Its molecular formula is C₁₀H₁₀BrNO₂. The product category is Aromatic amine products. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the 4-Bromo-3-oxo-N-phenylbutanamide are: (1)ACD/LogP: 1.91; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.91; (4)ACD/LogD (pH 7.4): 1.9; (5)ACD/BCF (pH 5.5): 16.75; (6)ACD/BCF (pH 7.4): 16.39; (7)ACD/KOC (pH 5.5): 261.69; (8)ACD/KOC (pH 7.4): 256.09; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 37.38 Å²; (13)Index of Refraction: 1.61; (14)Molar Refractivity: 57.55 cm³; (15)Molar Volume: 165.8 cm³; (16)Polarizability: 22.81×10^-24cm³; (17)Surface Tension: 53.1 dyne/cm; (18)Enthalpy of Vaporization: 69.39 kJ/mol; (19)Vapour Pressure: 7.55×10^-8mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(Nc1ccccc1)CC(=O)CBr
(2)InChI: InChI=1/C10H10BrNO2/c11-7-9(13)6-10(14)12-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,12,14)
(3)InChIKey: RJTROOIXLNVHNB-UHFFFAOYAK

Product Name

4-Bromo-3-oxo-N-phenylbutanamide

4-Bromo-3-oxo-N-phenylbutanamide Specification

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