Ethyl benzimidate hydrochloride supplier

Name
Ethyl benzimidate hydrochloride
EINECS 226-248-1
CAS No. 5333-86-8
Article Data35
CAS DataBase
Density 0.98 g/cm³
Solubility Soluble in water.
Melting Point ~125 °C (dec.)
Formula C₉H₁₁NO^.HCl
Boiling Point 192.9 °C at 760 mmHg
Molecular Weight 185.653
Flash Point 70.5 °C
Transport Information
Appearance
Safety 26
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols
Synonyms Benzenecarboximidicacid, ethyl ester, hydrochloride (9CI);Benzimidic acid, ethyl ester, hydrochloride(6CI,8CI);Benzimidoyl ethyl ether hydrochloride;Ethyl benzenecarboximidatehydrochloride;Ethyl benzimidate hydrochloride;Ethyl iminobenzoatehydrochloride;
PSA 33.08000
LogP 2.95020

Ethyl benzimidate hydrochloride Specification

The Ethyl benzimidate hydrochloride with its cas register number is 5333-86-8. It also can be called as Benzenecarboximidicacid, ethyl ester, hydrochloride (1:1) and the IUPAC Name about this chemical is ethyl benzenecarboximidate hydrochloride. It belongs to the following product categories, such as Amidates/Imidates, Nitrogen Compounds, Organic Building Blocks and so on.

Physical properties about Ethyl benzimidate hydrochloride are: (1)ACD/LogP: 2.01; (2)ACD/LogD (pH 5.5): 1; (3)ACD/LogD (pH 7.4): 2; (4)ACD/BCF (pH 5.5): 3; (5)ACD/BCF (pH 7.4): 17; (6)ACD/KOC (pH 5.5): 41; (7)ACD/KOC (pH 7.4): 255; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 33.08Å²; (12)Index of Refraction: 1.502; (13)Molar Refractivity: 44.59 cm³; (14)Molar Volume: 151.191 cm³; (15)Polarizability: 17.677x10^-24cm³; (16)Surface Tension: 34.282 dyne/cm; (17)Enthalpy of Vaporization: 41.152 kJ/mol; (18)Vapour Pressure: 0.666 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCOC(=N)C1=CC=CC=C1.Cl
(2)InChI: InChI=1S/C9H11NO.ClH/c1-2-11-9(10)8-6-4-3-5-7-8;/h3-7,10H,2H2,1H3;1H
(3)InChIKey: MODZVIMSNXSQIH-UHFFFAOYSA-N

Product Name

Ethyl benzimidate hydrochloride

Ethyl benzimidate hydrochloride Specification

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