Cas no 850349-96-1 (2-Pyridinamine,5-bromo-N-hexyl-)
850349-96-1 structure
Product Name:2-Pyridinamine,5-bromo-N-hexyl-
CAS No:850349-96-1
MF:C11H17BrN2
MW:257.170081853867
CID:716886
Update Time:2024-01-31
2-Pyridinamine,5-bromo-N-hexyl- Chemical and Physical Properties
Names and Identifiers
-
- 2-Pyridinamine,5-bromo-N-hexyl-
- 5-bromo-N-hexyl-2-Pyridinamine
- 5-bromo-N-hexylpyridin-2-amine
- 5-BROMO-N-HEXYLPYRIDIN-AMINE
- 2-Pyridinamine,5-bromo-N-hexyl
- 2-Pyridinamine, 5-bromo-N-hexyl-
-
- Inchi： 1S/C11H17BrN2/c1-2-3-4-5-8-13-11-7-6-10(12)9-14-11/h6-7,9H,2-5,8H2,1H3,(H,13,14)
- InChI Key： CLBBDEGBRCDYEE-UHFFFAOYSA-N
- SMILES： C1(NCCCCCC)=NC=C(Br)C=C1
Computed Properties
- Exact Mass: 256.05800
- Monoisotopic Mass: 256.057511
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 6
- Complexity: 141
- 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
- Topological Polar Surface Area: 24.9
Experimental Properties
- PSA: 24.92000
- LogP: 3.90930
2-Pyridinamine,5-bromo-N-hexyl- Related Literature
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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