Cas no 59715-29-6 (2-chloro-1-methyl-1H-pyrido[2,3-b]indole)
![2-chloro-1-methyl-1H-pyrido[2,3-b]indole structure](https://ossimg.kuujia.com/scimg/60000/59715-29-6x500.png)
59715-29-6 structure
Product Name:2-chloro-1-methyl-1H-pyrido[2,3-b]indole
CAS No:59715-29-6
MF:C12H9ClN2
MW:216.666261434555
CID:1622385
PubChem ID:186725
Update Time:2025-04-21
2-chloro-1-methyl-1H-pyrido[2,3-b]indole Chemical and Physical Properties
Names and Identifiers
-
- 2-chloro-1-methyl-1H-pyrido[2,3-b]indole
- 2-chloro-1-methylpyrido[2,3-b]indole
- 1H-Pyrido(2,3-b)indole, 2-chloro-1-methyl-
- DTXSID20975120
- 59715-29-6
- Oprea1_678429
-
- Inchi： 1S/C12H9ClN2/c1-15-11(13)7-6-9-8-4-2-3-5-10(8)14-12(9)15/h2-7H,1H3
- InChI Key： MWEIHQRCXLYWOI-UHFFFAOYSA-N
- SMILES： ClC1=CC=C2C3C=CC=CC=3N=C2N1C
Computed Properties
- Exact Mass: 216.04557
- Monoisotopic Mass: 216.0454260g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 15
- Rotatable Bond Count: 0
- Complexity: 246
- 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: 3.3
- Topological Polar Surface Area: 17.8?2
Experimental Properties
- PSA: 15.6
2-chloro-1-methyl-1H-pyrido[2,3-b]indole Related Literature
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
59715-29-6 (2-chloro-1-methyl-1H-pyrido[2,3-b]indole) Related Products
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