-
Name
METHYL 4-(AMINOMETHYL)BENZOATE HYDROCHLORIDE
- EINECS
- CAS No. 6232-11-7
- Article Data38
- CAS DataBase
- Density 1.45 g/cm3
- Solubility
- Melting Point 243 °C (dec.)(lit.)
- Formula C9H11NO2.HCl
- Boiling Point
- Molecular Weight 201.653
- Flash Point
- Transport Information
- Appearance
- Safety 26
- Risk Codes 36/37/38
-
Molecular Structure
-
Hazard Symbols
Xi
- Synonyms Benzoic acid,4-(aminomethyl)-, methyl ester, hydrochloride (9CI);p-Toluic acid, a-amino-, methyl ester,hydrochloride (7CI,8CI);4-(Aminomethyl)benzoic acid methyl esterhydrochloride;4-(Methoxycarbonyl)benzylammonium chloride;4-Methoxycarbonylbenzylamine hydrochloride;Methyl 4-(aminomethyl)benzoatehydrochloride;Methyl 4-(aminomethyl)benzoate monohydrochloride;p-Carbomethoxybenzylamine hydrochloride;
- PSA
- LogP
Methyl 4-(aminomethyl)benzoate hydrochloride Specification
The Methyl 4-(aminomethyl)benzoate hydrochloride, with CAS registry number 6232-11-7, belongs to the following product categories: (1)C8 to C9; (2)Carbonyl Compounds; (3)Esters. Its systematic name and its IUPAC name are the same, which is methyl 4-(aminomethyl)benzoate hydrochloride. This chemical is a kind of white crystalline powder.
Preparation: this chemical can be prepared by methyl N-Boc-p-aminomethylbenzoate. This reaction will need reagent NH4Cl and solvent dioxane. The reaction time is 1 hour(s). The yield is about 66%.
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Uses of Methyl 4-(aminomethyl)benzoate hydrochloride: it can be used to produce Methyl-p-(N,N-dimethylaminomethyl)-benzoat. This reaction will need reagent and solvent 88% aq. HCOOH. The reaction time is 4 hour(s). The yield is about 64%.
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You can still convert the following datas into molecular structure:
(1)SMILES: COC(=O)c1ccc(cc1)CN.Cl
(2)InChI: InChI=1/C9H11NO2.ClH/c1-12-9(11)8-4-2-7(6-10)3-5-8;/h2-5H,6,10H2,1H3;1H
(3)InChIKey: GIZCKBSSWNIUMZ-UHFFFAOYAJ
(4)Std. InChI: InChI=1S/C9H11NO2.ClH/c1-12-9(11)8-4-2-7(6-10)3-5-8;/h2-5H,6,10H2,1H3;1H
(5)Std. InChIKey: GIZCKBSSWNIUMZ-UHFFFAOYSA-N
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