Cas no 915390-10-2 (((3R,4S)-4-(3-Fluorophenyl)pyrrolidin-3-yl)methanol)
915390-10-2 structure
Product Name:((3R,4S)-4-(3-Fluorophenyl)pyrrolidin-3-yl)methanol
CAS No:915390-10-2
MF:C11H14FNO
MW:195.23336648941
CID:69493
PubChem ID:57355768
Update Time:2025-04-18
((3R,4S)-4-(3-Fluorophenyl)pyrrolidin-3-yl)methanol Chemical and Physical Properties
Names and Identifiers
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- ((3R,4S)-4-(3-Fluorophenyl)pyrrolidin-3-yl)methanol
- [4-(3-fluorophenyl)pyrrolidin-3-yl]methanol
- [(3R,4S)-4-(3-fluorophenyl)pyrrolidin-3-yl]methanol
- SCHEMBL4114431
- 915390-10-2
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- Inchi： 1S/C11H14FNO/c12-10-3-1-2-8(4-10)11-6-13-5-9(11)7-14/h1-4,9,11,13-14H,5-7H2/t9-,11-/m1/s1
- InChI Key： HOJIBLLFDVLDFW-MWLCHTKSSA-N
- SMILES： FC1=CC=CC(=C1)[C@H]1CNC[C@@H]1CO
Computed Properties
- Exact Mass: 195.10600
- Monoisotopic Mass: 195.106
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 188
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 32.3A^2
- XLogP3: 1
Experimental Properties
- Density: 1.136
- Boiling Point: 310.7 °C at 760 mmHg
- Flash Point: 141.7 °C
- Refractive Index: 1.523
- PSA: 32.26000
- LogP: 1.44980
((3R,4S)-4-(3-Fluorophenyl)pyrrolidin-3-yl)methanol Related Literature
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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3. Estimating and correcting interference fringes in infrared spectra in infrared hyperspectral imagingGhazal Azarfar,Ebrahim Aboualizadeh,Nicholas M. Walter,Simona Ratti,Camilla Olivieri,Alessandra Norici,Michael Nasse,Achim Kohler,Mario Giordano Analyst, 2018,143, 4674-4683
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Jonas Kind,Lukas Kaltschnee,Martin Leyendecker,Christina M. Thiele Chem. Commun., 2016,52, 12506-12509
915390-10-2 (((3R,4S)-4-(3-Fluorophenyl)pyrrolidin-3-yl)methanol) Related Products
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