Cas no 66946-82-5 ( )
structure
Product Name:
CAS No:66946-82-5
MF:C9H8FN
MW:149.164925575256
CID:874866
PubChem ID:12377727
Update Time:2025-04-19
Chemical and Physical Properties
Names and Identifiers
-
- 1H-Indole,3-fluoro-2-methyl-(9CI)
- 66946-82-5
- DTXSID901309903
- 3-fluoro-2-methyl-1H-indole
- 2-methyl-3-fluoroindole
- SCHEMBL12813178
- AKOS006306022
-
-
- Inchi： 1S/C9H8FN/c1-6-9(10)7-4-2-3-5-8(7)11-6/h2-5,11H,1H3
- InChI Key： IIPVOCGAPMWTSR-UHFFFAOYSA-N
- SMILES： FC1=C(C)NC2C=CC=CC=21
Computed Properties
- Exact Mass: 149.064077422g/mol
- Monoisotopic Mass: 149.064077422g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 149
- 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: 2.5
- Topological Polar Surface Area: 15.8?2
Related Literature
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
-
Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
-
4. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
-
Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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