Acetamide,N-[4-amino-2-(2-thienyl)phenyl]- supplier

Name
N-(4-amino-2-(thiophen-2-yl)phenyl)acetamide
EINECS 604-604-1
CAS No. 1131604-98-2
Density 1.294 g/cm³
Solubility
Melting Point
Formula C₁₂H₁₂N₂OS
Boiling Point 353.636 °C at 760 mmHg
Molecular Weight 232.30
Flash Point 167.674 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms N-(4-Amino-2-(thiophen-2-yl)phenyl)acetamide;N-[4-Amino-2-(2-thienyl)phenyl]acetamide;TC-010215;
PSA 86.85000
LogP 4.18640

Acetamide,N-[4-amino-2-(2-thienyl)phenyl]- Specification

The Acetamide,N-[4-amino-2-(2-thienyl)phenyl]- with CAS registry number of 1131604-98-2 is also known as N-[4-Amino-2-(2-thienyl)phenyl]acetamide. The IUPAC name is N-(4-Amino-2-(thiophen-2-yl)phenyl)acetamide. In addition, the formula is C₁₂H₁₂N₂OS and the molecular weight is 232.30.

Physical properties about Acetamide,N-[4-amino-2-(2-thienyl)phenyl]- are: (1)ACD/LogP: 0.76; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.74; (4)ACD/LogD (pH 7.4): 0.763; (5)ACD/BCF (pH 5.5): 2.123; (6)ACD/BCF (pH 7.4): 2.236; (7)ACD/KOC (pH 5.5): 58.767; (8)ACD/KOC (pH 7.4): 61.897; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 83.36Å²; (13)Index of Refraction: 1.678; (14)Molar Refractivity: 67.737 cm³; (15)Molar Volume: 179.561 cm³; (16)Polarizability: 26.853×10^-24cm³; (17)Surface Tension: 56.994 dyne/cm; (18)Density: 1.294 g/cm³; (19)Flash Point: 167.674 °C; (20)Enthalpy of Vaporization: 59.858 kJ/mol; (21)Boiling Point: 353.636 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
1. SMILES: CC(=O)Nc1ccc(cc1c2cccs2)N
2. InChI: InChI=1/C12H12N2OS/c1-8(15)14-11-5-4-9(13)7-10(11)12-3-2-6-16-12/h2-7H,13H2,1H3,(H,14,15)
3. InChIKey: LFSITCZZWXNYRI-UHFFFAOYAF
4. Std. InChI: InChI=1S/C12H12N2OS/c1-8(15)14-11-5-4-9(13)7-10(11)12-3-2-6-16-12/h2-7H,13H2,1H3,(H,14,15)
5. Std. InChIKey: LFSITCZZWXNYRI-UHFFFAOYSA-N

Product Name

N-(4-amino-2-(thiophen-2-yl)phenyl)acetamide

Acetamide,N-[4-amino-2-(2-thienyl)phenyl]- Specification

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