Products Categories
CAS No.: | 5255-71-0 |
---|---|
Name: | 2-(METHYLPHENYL) CARBAMIC ACID ETHYL ESTER |
Article Data: | 15 |
Molecular Structure: | |
Formula: | C10H13NO2 |
Molecular Weight: | 179.219 |
Synonyms: | Carbamicacid, (2-methylphenyl)-, ethyl ester (9CI);Carbanilic acid, o-methyl-, ethylester (6CI,7CI,8CI);Ethyl (2-methylphenyl)carbamate;Ethyl2-methylcarbanilate;Ethyl o-tolylcarbamate;N-o-Tolyl-O-ethylurethane;NSC44949; |
Density: | 1.108g/cm3 |
Boiling Point: | 222.9 °C at 760 mmHg |
Flash Point: | 88.6 °C |
PSA: | 38.33000 |
LogP: | 2.63640 |
What can I do for you?
Get Best Price
The Carbamic acid,N-(2-methylphenyl)-, ethyl ester, with CAS registry number 5255-71-0, has the systematic name of ethyl (2-methylphenyl)carbamate. Besides this, it is also called 2-(Methylphenyl) carbamic acid ethyl ester. And the chemical formula of this chemical is C10H13NO2.
Physical properties of Carbamic acid,N-(2-methylphenyl)-, ethyl ester: (1)ACD/LogP: 2.76; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.76; (4)ACD/LogD (pH 7.4): 2.76; (5)ACD/BCF (pH 5.5): 73.73; (6)ACD/BCF (pH 7.4): 73.73; (7)ACD/KOC (pH 5.5): 755.91; (8)ACD/KOC (pH 7.4): 755.93; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 29.54 Å2; (13)Index of Refraction: 1.552; (14)Molar Refractivity: 51.72 cm3; (15)Molar Volume: 161.6 cm3; (16)Polarizability: 20.5×10-24cm3; (17)Surface Tension: 40.6 dyne/cm; (18)Density: 1.108 g/cm3; (19)Flash Point: 88.6 °C; (20)Enthalpy of Vaporization: 45.94 kJ/mol; (21)Boiling Point: 222.9 °C at 760 mmHg; (22)Vapour Pressure: 0.0991 mmHg at 25°C.
Preparation: this chemical can be prepared by carbonochloridic acid ethyl ester and 1-methyl-2-nitro-benzene. This reaction will need reagents Sn, NH4Cl and methanol. The reaction time is 2 hour(s) with reaction temperature of 25 ℃. The yield is about 90%.
Uses of Carbamic acid,N-(2-methylphenyl)-, ethyl ester: it can be used to produce N,N'-di-o-tolyl-urea. The reaction time is 30 min with reaction temperature of 230 - 240 ℃. The yield is about 46%.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCC)Nc1ccccc1C
(2)InChI: InChI=1/C10H13NO2/c1-3-13-10(12)11-9-7-5-4-6-8(9)2/h4-7H,3H2,1-2H3,(H,11,12)
(3)InChIKey: KXOFYXSXZGSQED-UHFFFAOYAB
(4)Std. InChI: InChI=1S/C10H13NO2/c1-3-13-10(12)11-9-7-5-4-6-8(9)2/h4-7H,3H2,1-2H3,(H,11,12)
(5)Std. InChIKey: KXOFYXSXZGSQED-UHFFFAOYSA-N