Introduction：Basic information about CAS 51352-87-5|3-(2-Benzyl(methyl)aminoethyl)benzoic acid methyl ester hydrochloride, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 3-(2-Benzyl(methyl)aminoethyl)benzoic acid methyl ester hydrochloride |
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| CAS Number | 51352-87-5 | Molecular Weight | 319.826 |
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| Density | / | Boiling Point | 398.9ºC at 760 mmHg |
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| Molecular Formula | C18H22ClNO2 | Melting Point | / |
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| MSDS | / | Flash Point | 134ºC |
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Names
| Name | Methyl 3-(2-(benzyl(methyl)amino)ethyl)benzoate hydrochloride |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Boiling Point | 398.9ºC at 760 mmHg |
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| Molecular Formula | C18H22ClNO2 |
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| Molecular Weight | 319.826 |
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| Flash Point | 134ºC |
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| Exact Mass | 319.133911 |
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| PSA | 29.54000 |
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| LogP | 3.94970 |
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| InChIKey | HLBBSWSJLPLPRU-UHFFFAOYSA-N |
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| SMILES | COC(=O)c1cccc(CCN(C)Cc2ccccc2)c1.Cl |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- DG4226000
- CHEMICAL NAME :
- Benzoic acid, 3-(2-(benzylmethylamino)ethyl)-, methyl ester, hydrochloride
- CAS REGISTRY NUMBER :
- 51352-87-5
- LAST UPDATED :
- 199112
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C18-H21-N-O2.Cl-H
- MOLECULAR WEIGHT :
- 319.86
- WISWESSER LINE NOTATION :
- 1OVR C2N1&1R &GH
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 700 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- EXPEAM Experientia. (Birkhaeuser Verlag, POB 133, CH-4010 Basel, Switzerland) V.1- 1945- Volume(issue)/page/year: 30,271,1974
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 860 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- DRFUD4 Drugs of the Future. (J.R. Prous, S.A., Apartado de Correos 540, 08080 Barcelona, Spain) V.1- 1975/76- Volume(issue)/page/year: 4,50,1979
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Safety Information
| Hazard Codes | Xi |
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| HS Code | 2922499990 |
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Customs
| HS Code | 2922499990 |
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| Summary | HS:2922499990 other amino-acids, other than those containing more than one kind of oxygen function, and their esters; salts thereof VAT:17.0% Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) MFN tariff:6.5% General tariff:30.0% |
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Synonyms
| Benzoic acid, 3-[2-[methyl(phenylmethyl)amino]ethyl]-, methyl ester, hydrochloride (1:1) |
| N-Benzyl-2-[3-(methoxycarbonyl)phenyl]-N-methylethanaminium chlor ide |
| Methyl 3-{2-[benzyl(methyl)amino]ethyl}benzoate hydrochloride (1:1) |
| PRL-8-53 |
