((3S,4R)-4-(4-Chlorophenyl)pyrrolidin-3-yl)methanol is a complex chemical compound with a pyrrolidine core, featuring a tertiary alcohol group, a secondary amine, and an aryl chloride. The presence of multiple chiral centers on the 3rd and 4th carbon of the pyrrolidine ring suggests that ((3S,4R)-4-(4-Chlorophenyl)pyrrolidin-3-yl)methanol may exist in several stereoisomeric forms. Its connection to chlorophenyl hints at potential applications in the pharmaceutical industry, although specific uses and detailed functions are not publicly disclosed or may be proprietary. The synthesis of ((3S,4R)-4-(4-Chlorophenyl)pyrrolidin-3-yl)methanol likely demands sophisticated organic chemistry methods, and information regarding its potential toxicity and environmental effects is currently unknown.
55438-52-3
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Basic information
- Product Name: ((3S,4R)-4-(4-CHLOROPHENYL)PYRROLIDIN-3-YL)METHANOL
- Synonyms: ((3S,4R)-4-(4-CHLOROPHENYL)PYRROLIDIN-3-YL)METHANOL
- CAS NO:55438-52-3
- Molecular Formula: C11H14ClNO
- Molecular Weight: 211.69
- EINECS: N/A
- Product Categories: N/A
- Mol File: 55438-52-3.mol
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Chemical Properties
- Melting Point: N/A
- Boiling Point: 345.1 °C at 760 mmHg
- Flash Point: 162.5 °C
- Appearance: /
- Density: 1.179 g/cm3
- Vapor Pressure: 2.4E-05mmHg at 25°C
- Refractive Index: 1.552
- Storage Temp.: N/A
- Solubility: N/A
- PKA: 14.93±0.10(Predicted)
- CAS DataBase Reference: ((3S,4R)-4-(4-CHLOROPHENYL)PYRROLIDIN-3-YL)METHANOL(CAS DataBase Reference)
- NIST Chemistry Reference: ((3S,4R)-4-(4-CHLOROPHENYL)PYRROLIDIN-3-YL)METHANOL(55438-52-3)
- EPA Substance Registry System: ((3S,4R)-4-(4-CHLOROPHENYL)PYRROLIDIN-3-YL)METHANOL(55438-52-3)
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Safety Data
- Hazard Codes: N/A
- Statements: N/A
- Safety Statements: N/A
- WGK Germany:
- RTECS:
- HazardClass: N/A
- PackingGroup: N/A
- Hazardous Substances Data: 55438-52-3(Hazardous Substances Data)
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55438-52-3 Usage
Uses
Used in Pharmaceutical Industry:((3S,4R)-4-(4-Chlorophenyl)pyrrolidin-3-yl)methanol is used as a potential pharmaceutical compound for its structural features that may contribute to its interaction with biological targets. The presence of a chlorophenyl group and the chiral centers on the pyrrolidine ring could be crucial for its activity and selectivity in medicinal applications.
Used in Advanced Organic Chemistry Research:
((3S,4R)-4-(4-Chlorophenyl)pyrrolidin-3-yl)methanol serves as a subject of study in the field of advanced organic chemistry, where its synthesis and properties are explored. ((3S,4R)-4-(4-Chlorophenyl)pyrrolidin-3-yl)methanol's complex structure and the possibility of multiple stereoisomers make it an interesting case for research into synthesis techniques and the investigation of stereochemistry's impact on chemical behavior and potential applications.
Used in Toxicology and Environmental Studies:
While not explicitly stated, the potential toxicity and environmental impacts of ((3S,4R)-4-(4-Chlorophenyl)pyrrolidin-3-yl)methanol could be a focus of research in toxicology and environmental science. Understanding the safety profile and ecological effects of such compounds is essential for responsible development and use in any application, including pharmaceuticals.
Check Digit Verification of cas no
The CAS Registry Mumber 55438-52-3 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 5,5,4,3 and 8 respectively; the second part has 2 digits, 5 and 2 respectively.Calculate Digit Verification of CAS Registry Number 55438-52:
(7*5)+(6*5)+(5*4)+(4*3)+(3*8)+(2*5)+(1*2)=133
133 % 10 = 3
So 55438-52-3 is a valid CAS Registry Number.
InChI:InChI=1/C11H14ClNO/c12-10-3-1-8(2-4-10)11-6-13-5-9(11)7-14/h1-4,9,11,13-14H,5-7H2/t9-,11-/m0/s1
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((3S,4R)-4-(4-CHLOROPHENYL)PYRROLIDIN-3-YL)METHANOL
