CAS Number101385-90-4
SynonymsS-(-)-1-Benzyl-3-pyrrolidinol; (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
Molecular FormulaC11H15NO
Molecular Weight177.24
Purity99%
Density1.0±0.1 g/cm3
Boiling Point115 °C/0.8 mmHg (lit.)
Appearanceliquid
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 101385-90-4 |
| Catalog No. | 2A-9000337 |
| Chinese Name | (S)-3-羟基-1-苄基吡咯烷 |
| Synonyms | S-(-)-1-Benzyl-3-pyrrolidinol; (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 |
| Molecular Formula | C11H15NO |
| Molecular Weight | 177.24 |
| Purity | 99 |
| Density | 1.0±0.1 g/cm3 |
| Boiling Point | 115 °C/0.8 mmHg (lit.) |
| Appearance | liquid |
| Storage Condition | Sealed and stored in a cool, dry warehouse. Refrig |
| Application | (S)-1-Benzylpyrrolidin-3-ol (compound 14) can be used to synthesize impurities in the antihypertensive drug barnidipine hydrochloride (HY-107322) [1]. |
| HTC | 2933990090 |
| PubChem ID | 24862730 |
| MDL Number | MFCD00075485 |
| SMILES | O[C@H]1CCN(C1)Cc2ccccc2 |
| InChI | 1S/C11H15NO/c13-11-6-7-12(9-11)8-10-4-2-1-3-5-10/h1-5,11,13H,6-9H2/t11-/m0/s1 |
| InChI Key | YQMXOIAIYXXXEE-NSHDSACASA-N |
| NACRES Code | NA.22 |
| UNSPSC | 12352005 |
| Hazard Symbols | Transport |
| Risk Codes | R36/37/38 |
| Safety Description | S26;S37/39 |
| MSDS | msds/337_1_101385_90_4.pdf |
| Bioactivity | (S)-1-Benzylpyrrolidin-3-ol (Compound 14) can be used to synthesis impurities of the anti-hypertensive drug Barnidipine hydrochloride (HY-107322)[1]. Related Catalog Research Areas >> Others Signaling Pathways >> Others >> Others 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. Chemical & Physical Properties Density 1.0±0.1 g/cm3 Boiling Point 237.3±9.0 °C at 760 mmHg Molecular Formula C11H15NO Molecular Weight 175.270 Flash Point 88.7±15.6 °C Exact Mass 175.136093 PSA 23.47000 LogP 2.68 Vapour Pressure 0.0±0.5 mmHg at 25°C Index of Refraction 1.540 InChIKey YQMXOIAIYXXXEE-NSHDSACASA-N SMILES OC1CCN(Cc2ccccc2)C1 |
| Use of | (S)-1-Benzylpyrrolidin-3-ol (Compound 14) can be used to synthesis impurities of the anti-hypertensive drug Barnidipine hydrochloride (HY-107322)[1]. Properties Name (S)-1-Benzyl-3-Pyrrolidinol Synonym More Synonyms (3S)-1-Benzyl-3-methylpyrrolidine Biological Activity Description (S)-1-Benzylpyrrolidin-3-ol (Compound 14) can be used to synthesis impurities of the anti-hypertensive drug Barnidipine hydrochloride (HY-107322)[1]. Related Catalog Research Areas >> Others Signaling Pathways >> Others >> Others 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. Chemical & Physical Properties Molecular Formula C11H15NO Exact Mass 175.136093 PSA 23.47000 Index of Refraction 1.540 InChIKey YQMXOIAIYXXXEE-NSHDSACASA-N |
| Tax Rebate | 13.0% |
| Supervision | None. MFN tariff: 6.5%. Ordinary tariff: 20.0% |
| Transport Info | Shipping Name: UN |
| MSDS Transport Info | Module 14. Shipping information 14.1 UN dangerous goods number European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.2 United Nations shipping name European Land Transport Dangerous Regulations: Non-dangerous goods IMDG Code: Non-dangerous goods International air transport dangerous goods regulations: non-dangerous goods 14.3 Transport hazard categories European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.4 Package group European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.5 Environmental hazards European Land Transport Danger Regulations: No International Maritime Danger Regulations International Air Transport Danger Regulations: No Marine pollutants (yes/no): No 14.6 Special reminder to users No data available |
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