Cas no 477585-20-9 (4-Bromo-2,3,5-trimethylpyridine)
477585-20-9 structure
Product Name:4-Bromo-2,3,5-trimethylpyridine
CAS No:477585-20-9
MF:C8H10BrN
MW:200.075701236725
CID:2646287
PubChem ID:58742154
Update Time:2025-04-21
4-Bromo-2,3,5-trimethylpyridine Chemical and Physical Properties
Names and Identifiers
-
- 4-bromo-2,3,5-trimethylpyridine
- SCHEMBL14438199
- DB-167157
- 477585-20-9
- 4-Bromo-2,3,5-trimethylpyridine
-
- Inchi: 1S/C8H10BrN/c1-5-4-10-7(3)6(2)8(5)9/h4H,1-3H3
- InChI Key: UTCFYSGOQHYTAT-UHFFFAOYSA-N
- SMILES: BrC1C(C)=CN=C(C)C=1C
Computed Properties
- Exact Mass: 198.99966Da
- Monoisotopic Mass: 198.99966Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 116
- 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: 2.7
- Topological Polar Surface Area: 12.9?2
4-Bromo-2,3,5-trimethylpyridine Related Literature
-
Christian K. Rank,Alexander W. Jones,Tatjana Wall,Patrick Di Martino-Fumo,Sarah Schr?ck,Markus Gerhards,Frederic W. Patureau Chem. Commun., 2019,55, 13749-13752
-
P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
-
Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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