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59104-19-7

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Basic Information
CAS No.: 59104-19-7
Name: 2-(4-CHLORO-PHENOXY)-ACETAMIDINE HCL
Article Data: 3
Molecular Structure:
Molecular Structure of 59104-19-7 (2-(4-CHLORO-PHENOXY)-ACETAMIDINE HCL)
Formula: C8H10Cl2N2O
Molecular Weight: 221.086
Synonyms: 2-(4-Chlorophenoxy)ethanamidine, chloride;2-(4-Chloro-phenoxy)acetamidine hydrochloride, 97%;2-(4-CHLORO-PHENOXY)-ACETAMIDINE HCL;
Melting Point: 185-187 °C
Boiling Point: 306.4 °C at 760 mmHg
Flash Point: 139.1 °C
Hazard Symbols: IrritantXi
PSA: 59.10000
LogP: 3.25680
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Specification

The Ethanimidamide,2-(4-chlorophenoxy)-, hydrochloride (1:1), with the CAS registry number 59104-19-7, is also known as 2-(4-Chlorophenoxy)ethanamidine, chloride. It belongs to the product category of Pharmacetical. Its EINECS number is 222-432-0. This chemical's molecular formula is C8H10Cl2N2O and molecular weight is 221.08. What's more, its systematic name is 1-amino-2-(4-chlorophenoxy)ethaniminium chloride. When you are using this chemical, please be cautious about it. It that may cause inflammation to the skin or other mucous membranes.

Physical properties of Ethanimidamide,2-(4-chlorophenoxy)-, hydrochloride (1:1) are: (1)ACD/LogP: 1.00; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1; (4)ACD/LogD (pH 7.4): -0.96; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 15.48 Å2; (13)Flash Point: 139.1 °C; (14)Enthalpy of Vaporization: 54.69 kJ/mol; (15)Boiling Point: 306.4 °C at 760 mmHg; (16)Vapour Pressure: 0.000774 mmHg at 25°C.

Uses of Ethanimidamide,2-(4-chlorophenoxy)-, hydrochloride (1:1): it can be used to produce 2-(4-chloro-phenoxymethyl)-4-phenyl-pyrimidine. The yield is about 45%.

Ethanimidamide,2-(4-chlorophenoxy)-, hydrochloride (1:1) can be used to produce 2-(4-chloro-phenoxymethyl)-4-phenyl-pyrimidine

You can still convert the following datas into molecular structure:
(1)SMILES: [Cl-].Clc1ccc(OCC(=[NH2+])\N)cc1
(2)Std. InChI: InChI=1S/C8H9ClN2O.ClH/c9-6-1-3-7(4-2-6)12-5-8(10)11;/h1-4H,5H2,(H3,10,11);1H
(3)Std. InChIKey: BNKARSAFQJBQPH-UHFFFAOYSA-N