Cas no 155627-31-9 ((S)-3-Benzylpyrrolidine)
(S)-3-Benzylpyrrolidine structure
Product Name:(S)-3-Benzylpyrrolidine
CAS No:155627-31-9
MF:C11H15N
MW:161.120453
CID:4742178
Update Time:2020-10-14
(S)-3-Benzylpyrrolidine Chemical and Physical Properties
Names and Identifiers
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- (S)-3-Benzylpyrrolidine
- (3S)-3-Benzylpyrrolidine
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- Inchi： 1S/C11H15N/c1-2-4-10(5-3-1)8-11-6-7-12-9-11/h1-5,11-12H,6-9H2/t11-/m1/s1
- InChI Key： HFBLCYZEOGXHDP-LLVKDONJSA-N
- SMILES： N1([H])C([H])([H])C([H])([H])[C@]([H])(C([H])([H])C2C([H])=C([H])C([H])=C([H])C=2[H])C1([H])[H]
Computed Properties
- Exact Mass: 161.120449g/mol
- Monoisotopic Mass: 161.120449g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 127
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Molecular Weight: 161.24g/mol
- XLogP3: 2.1
- Topological Polar Surface Area: 12
(S)-3-Benzylpyrrolidine Related Literature
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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