Ethyl 4,5-bis(2-methoxyethoxy)-2-aminobenzoate supplier

Name
Ethyl 4,5-bis(2-methoxyethoxy)-2-aminobenzoate
EINECS 700-551-3
CAS No. 179688-27-8
Article Data17
CAS DataBase
Density 1.148 g/cm³
Solubility
Melting Point
Formula C₁₅H₂₃NO₆
Boiling Point 456.4 °C at 760 mmHg
Molecular Weight 313.351
Flash Point 183.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-Amino-4,5-bis(2-methoxyethoxy)benzoicacid ethyl ester;4,5-Bis(2-methoxyethoxy)anthranilic acid ethyl ester;Ethyl2-amino-4,5-bis(2-methoxyethoxy)benzoate;
PSA 89.24000
LogP 2.07710

Ethyl 4,5-bis(2-methoxyethoxy)-2-aminobenzoate Specification

This chemical is called Benzoic acid, 2-amino-4,5-bis(2-methoxyethoxy)-, ethyl ester, and its systematic name is ethyl 2-amino-4,5-bis(2-methoxyethoxy)benzoate. With the molecular formula of C₁₅H₂₃NO₆, its molecular weight is 313.35. The CAS registry number of this chemical is 179688-27-8. Additionally, its product category is Intermidiate of Erlotinib Hydrochloride.

Other characteristics of the Benzoic acid, 2-amino-4,5-bis(2-methoxyethoxy)-, ethyl ester can be summarised as followings: (1)ACD/LogP: 1.64; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.64; (4)ACD/LogD (pH 7.4): 1.64; (5)ACD/BCF (pH 5.5): 10.45; (6)ACD/BCF (pH 7.4): 10.46; (7)ACD/KOC (pH 5.5): 186.7; (8)ACD/KOC (pH 7.4): 186.8; (9)#H bond acceptors: 7; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 12; (12)Polar Surface Area: 66.46 Å²; (13)Index of Refraction: 1.514; (14)Molar Refractivity: 82.27 cm³; (15)Molar Volume: 272.8 cm³; (16)Polarizability: 32.61×10^-24cm³; (17)Surface Tension: 40.7 dyne/cm; (18)Density: 1.148 g/cm³; (19)Flash Point: 183.9 °C; (20)Enthalpy of Vaporization: 71.64 kJ/mol; (21)Boiling Point: 456.4 °C at 760 mmHg; (22)Vapour Pressure: 1.62E-08 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: O=C(OCC)c1c(cc(OCCOC)c(OCCOC)c1)N
2.InChI: InChI=1/C15H23NO6/c1-4-20-15(17)11-9-13(21-7-5-18-2)14(10-12(11)16)22-8-6-19-3/h9-10H,4-8,16H2,1-3H3
3.InChIKey: YZOWMIHUDJVXBH-UHFFFAOYAR

Product Name

Ethyl 4,5-bis(2-methoxyethoxy)-2-aminobenzoate

Ethyl 4,5-bis(2-methoxyethoxy)-2-aminobenzoate Specification

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