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Acetamide,N-[(2-bromophenyl)methyl]-

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Name

Acetamide,N-[(2-bromophenyl)methyl]-

EINECS N/A
CAS No. 74315-07-4 Density 1.417 g/cm3
PSA 29.10000 LogP 2.47610
Solubility N/A Melting Point 78-80℃
Formula C9H10BrNO Boiling Point 389.7 °C at 760 mmHg
Molecular Weight 228.088 Flash Point 189.5 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 74315-07-4 (N-(2-BROMOBENZYL)ACETAMIDE) Hazard Symbols N/A
Synonyms

N-(2-Bromobenzyl)acetamide;N1-(2-Bromobenzyl)acetamide;N-[(2-Bromophenyl)methyl]acetamide;

Article Data 8

Acetamide,N-[(2-bromophenyl)methyl]- Specification

The Acetamide,N-[(2-bromophenyl)methyl]- with CAS registry number of 74315-07-4 is also known as N-[(2-Bromophenyl)methyl]acetamide. Its systematic name is N-(2-Bromobenzyl)acetamide. In addition, the formula is C9H10BrNO and the molecular weight is 228.09. This chemical should be stored in sealed containers in cool, dry place and away from oxidizing agents.

Physical properties about Acetamide,N-[(2-bromophenyl)methyl]- are: (1)ACD/LogP: 1.51; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.51; (4)ACD/LogD (pH 7.4): 1.51; (5)ACD/BCF (pH 5.5): 8.32; (6)ACD/BCF (pH 7.4): 8.32; (7)ACD/KOC (pH 5.5): 158.57; (8)ACD/KOC (pH 7.4): 158.57; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 20.31Å2; (13)Index of Refraction: 1.556; (14)Molar Refractivity: 51.74 cm3; (15)Molar Volume: 160.8 cm3; (16)Polarizability: 20.51×10-24cm3; (17)Surface Tension: 41 dyne/cm; (18)Density: 1.417 g/cm3; (19)Flash Point: 189.5 °C; (20)Enthalpy of Vaporization: 63.91 kJ/mol; (21)Boiling Point: 389.7 °C at 760 mmHg; (22)Vapour Pressure: 2.79E-06 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
1. SMILES: Brc1ccccc1CNC(=O)C
2. InChI: InChI=1/C9H10BrNO/c1-7(12)11-6-8-4-2-3-5-9(8)10/h2-5H,6H2,1H3,(H,11,12)
3. InChIKey: BWFCPQHLMPFBQH-UHFFFAOYAO
4. Std. InChI: InChI=1S/C9H10BrNO/c1-7(12)11-6-8-4-2-3-5-9(8)10/h2-5H,6H2,1H3,(H,11,12)
5. Std. InChIKey: BWFCPQHLMPFBQH-UHFFFAOYSA-N

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