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CAS No.: | 61-88-1 |
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Name: | (2-AMINO-PHENYL)-ACETIC ACID ETHYL ESTER HCL |
Molecular Structure: | |
Formula: | C10H14ClNO2 |
Molecular Weight: | 215.68 |
Synonyms: | Aceticacid, (o-aminophenyl)-, ethyl ester, hydrochloride (7CI,8CI);Benzeneaceticacid, 2-amino-, ethyl ester, hydrochloride (9CI);Ethyl o-aminophenylacetatehydrochloride; |
Boiling Point: | 292.8 °C at 760 mmHg |
Flash Point: | 149.7 °C |
PSA: | 52.32000 |
LogP: | 2.75760 |
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The Benzeneacetic acid,2-amino-, ethyl ester, hydrochloride is an organic compound with the formula C10H14ClNO2. The systematic name of this chemical is Ethyl (2-aminophenyl)acetate hydrochloride. With the CAS registry number 61-88-1, it is also named as Ethyl 2-(2-aminophenyl)acetate hydrochloride. Besides, its molecular weight is 215.68.
The physical properties of Benzeneacetic acid,2-amino-, ethyl ester, hydrochloride are: (1)ACD/LogP: 1.22; (2)ACD/LogD (pH 5.5): 1.21; (3)ACD/LogD (pH 7.4): 1.22; (4)ACD/BCF (pH 5.5): 4.86; (5)ACD/BCF (pH 7.4): 4.94; (6)ACD/KOC (pH 5.5): 107.44; (7)ACD/KOC (pH 7.4): 109.15; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 5; (11)Polar Surface Area: 29.54 Å2; (12)Flash Point: 149.7 °C; (13)Enthalpy of Vaporization: 53.23 kJ/mol; (14)Boiling Point: 292.8 °C at 760 mmHg; (15)Vapour Pressure: 0.0018 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cl.O=C(OCC)Cc1ccccc1N
(2)InChI: InChI=1/C10H13NO2.ClH/c1-2-13-10(12)7-8-5-3-4-6-9(8)11;/h3-6H,2,7,11H2,1H3;1H
(3)InChIKey: QITKMRXHUSYVSD-UHFFFAOYAH
(4)Std. InChI: InChI=1S/C10H13NO2.ClH/c1-2-13-10(12)7-8-5-3-4-6-9(8)11;/h3-6H,2,7,11H2,1H3;1H
(5)Std. InChIKey: QITKMRXHUSYVSD-UHFFFAOYSA-N