Cas no 500221-73-8 ((3-Fluoro-benzyl)-pyridin-3-ylmethyl-amine)
500221-73-8 structure
Product Name:(3-Fluoro-benzyl)-pyridin-3-ylmethyl-amine
CAS No:500221-73-8
MF:C13H13FN2
MW:216.254126310349
CID:3078154
PubChem ID:846153
Update Time:2025-04-21
(3-Fluoro-benzyl)-pyridin-3-ylmethyl-amine Chemical and Physical Properties
Names and Identifiers
-
- (3-Fluoro-benzyl)-pyridin-3-ylmethyl-amine
- STK129688
- SR-01000325670
- N-(3-Fluorobenzyl)-1-(pyridin-3-yl)methanamine
- AKOS000300160
- 1-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)methanamine
- SR-01000325670-1
- [(3-fluorophenyl)methyl](pyridin-3-ylmethyl)amine
- 500221-73-8
-
- MDL: MFCD03724410
- Inchi: 1S/C13H13FN2/c14-13-5-1-3-11(7-13)8-16-10-12-4-2-6-15-9-12/h1-7,9,16H,8,10H2
- InChI Key: NKWRFELRHSZCJV-UHFFFAOYSA-N
- SMILES: FC1=CC=CC(=C1)CNCC1C=NC=CC=1
Computed Properties
- Exact Mass: 216.10627659Da
- Monoisotopic Mass: 216.10627659Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 4
- Complexity: 198
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.8
- Topological Polar Surface Area: 24.9?2
(3-Fluoro-benzyl)-pyridin-3-ylmethyl-amine Related Literature
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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