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CAS No.: | 5434-30-0 |
---|---|
Name: | N1-(5-AMINO-2-METHYLPHENYL)ACETAMIDE |
Article Data: | 10 |
Molecular Structure: | |
Formula: | C9H12N2O |
Molecular Weight: | 164.207 |
Synonyms: | 2-Acetylamino-4-aminotoluene;Acetamide, N-(5-amino-2-methylphenyl)-;N-(5-Amino-2-methylphenyl)acetamide;5'-Amino-2'-methylacetanilide;N1-(5-Amino-2-methylphenyl)acetamide;2-Methyl-5-aminoacetaniline;5-Amino-2-methylacetanilide;2-Acetylamino-p-toluidine; |
EINECS: | 226-599-0 |
Density: | 1.164 g/cm3 |
Melting Point: | 141°C |
Boiling Point: | 362.123 °C at 760 mmHg |
Flash Point: | 172.806 °C |
Hazard Symbols: | Xi |
PSA: | 55.12000 |
LogP: | 2.18980 |
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This chemical is called N-(5-Amino-2-methylphenyl)acetamide, and it can also be named as 2-Acetylamino-4-aminotoluene. With the CAS registry number of 5434-30-0, its molecular formula is C9H12N2O. In addition, the molecular weight of the N-(5-Amino-2-methylphenyl)acetamide is 164.20. And the product categories of this chemical are Intermediates of Dyes and Pigments.
Other characteristics of the N-(5-Amino-2-methylphenyl)acetamide can be summarised as followings: (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 16.708; (5)ACD/KOC (pH 7.4): 20.291; (6)#H bond acceptors: 3; (7)#H bond donors: 3; (8)#Freely Rotating Bonds: 2; (9)Polar Surface Area: 55.12Å2; (10)Index of Refraction: 1.621; (11)Molar Refractivity: 49.586 cm3; (12)Molar Volume: 141.072 cm3; (13)Polarizability: 19.657×10-24cm3; (14)Surface Tension: 49.66 dyne/cm; (15)Density: 1.164 g/cm3; (16)Flash Point: 172.806 °C; (17)Enthalpy of Vaporization: 60.803 kJ/mol; (18)Boiling Point: 362.123 °C at 760 mmHg; (19)Vapour Pressure: 0 mmHg at 25°C;(20)Melting Point: 141°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cc1ccc(cc1NC(=O)C)N
(2)InChI: InChI=1/C9H12N2O/c1-6-3-4-8(10)5-9(6)11-7(2)12/h3-5H,10H2,1-2H3,(H,11,12)
(3)InChIKey: UAZGSMMESOKKQZ-UHFFFAOYAB
(4)Std. InChI: InChI=1S/C9H12N2O/c1-6-3-4-8(10)5-9(6)11-7(2)12/h3-5H,10H2,1-2H3,(H,11,12)
(5)Std. InChIKey: UAZGSMMESOKKQZ-UHFFFAOYSA-N