Introduction：Basic information about CAS 101385-90-4|(3S)-1-Benzyl-3-methylpyrrolidine, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | (3S)-1-Benzyl-3-methylpyrrolidine |
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| CAS Number | 101385-90-4 | Molecular Weight | 175.270 |
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| Density | 1.0±0.1 g/cm3 | Boiling Point | 237.3±9.0 °C at 760 mmHg |
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| Molecular Formula | C11H15NO | Melting Point | / |
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| MSDS | ChineseUSA | Flash Point | 88.7±15.6 °C |
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| Symbol |
GHS07 | Signal Word | Warning |
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Names
| Name | (S)-1-Benzyl-3-Pyrrolidinol |
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| Synonym | More Synonyms |
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(3S)-1-Benzyl-3-methylpyrrolidine BiologicalActivity
| Description | (S)-1-Benzylpyrrolidin-3-ol (Compound 14) can be used to synthesis impurities of the anti-hypertensive drug Barnidipine hydrochloride (HY-107322)[1]. |
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| Related Catalog | Research Areas >>OthersSignaling Pathways >>Others >>Others |
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| References | [1]. Cheng ZG, et al . Synthesis and characterization of impurities of barnidipine hydrochloride, an antihypertensive drug substance. Molecules. 2014 Jan 21;19(1):1344-52. |
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Chemical & Physical Properties
| Density | 1.0±0.1 g/cm3 |
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| Boiling Point | 237.3±9.0 °C at 760 mmHg |
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| Molecular Formula | C11H15NO |
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| Molecular Weight | 175.270 |
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| Flash Point | 88.7±15.6 °C |
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| Exact Mass | 175.136093 |
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| PSA | 23.47000 |
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| LogP | 2.68 |
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| Vapour Pressure | 0.0±0.5 mmHg at 25°C |
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| Index of Refraction | 1.540 |
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| InChIKey | YQMXOIAIYXXXEE-NSHDSACASA-N |
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| SMILES | OC1CCN(Cc2ccccc2)C1 |
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Safety Information
| Symbol |
GHS07 |
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| Signal Word | Warning |
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| Hazard Statements | H315-H319-H335 |
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| Precautionary Statements | P261-P305 + P351 + P338 |
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| Personal Protective Equipment | Eyeshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
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| Hazard Codes | Xi:Irritant |
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| Risk Phrases | R36/37/38 |
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| Safety Phrases | S26-S37/39 |
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| RIDADR | NONH for all modes of transport |
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| WGK Germany | 3 |
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| HS Code | 2933990090 |
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Customs
| HS Code | 2933990090 |
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| Summary | 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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Synonyms
| S-(-)-1-Benzyl-3-pyrrolidinol |
| Pyrrolidine, 3-methyl-1-(phenylmethyl)-, (3S)- |
| (3S)-1-benzylpyrrolidin-3-ol |
| MFCD00075485 |
| (S)-1-Benzyl-3-hydroxypyrrolidine |
| (S)-1-Benzylpyrrolidin-3-ol |
| (S)-1-Benzyl-3-pyrrolidinol |
| (S)-(−)-1-Benzyl-3-pyrrolidinol |
| (3S)-1-Benzyl-3-methylpyrrolidine |
| (S)-(-)-1-Benzyl-3-pyrrolidinol |
| EINECS 212-273-5 |
