Cas no 141307-00-8 (1H-Indol-1-amine, 3-(4-fluorophenyl)-5-methyl-)
141307-00-8 structure
Product Name:1H-Indol-1-amine, 3-(4-fluorophenyl)-5-methyl-
CAS No:141307-00-8
MF:C15H13FN2
MW:240.275526762009
CID:1306107
PubChem ID:10083004
Update Time:2025-04-20
1H-Indol-1-amine, 3-(4-fluorophenyl)-5-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Indol-1-amine, 3-(4-fluorophenyl)-5-methyl-
- 1-Amino-3-(4-fluorophenyl)-5-methyl-1H-indole
- SCHEMBL9269161
- 141307-00-8
- UETCHIADDHDCHP-UHFFFAOYSA-N
- 1h-indol-1-amine,3-(4-fluorophenyl)-5-methyl-
-
- Inchi： 1S/C15H13FN2/c1-10-2-7-15-13(8-10)14(9-18(15)17)11-3-5-12(16)6-4-11/h2-9H,17H2,1H3
- InChI Key： UETCHIADDHDCHP-UHFFFAOYSA-N
- SMILES： FC1C=CC(=CC=1)C1=CN(C2C=CC(C)=CC1=2)N
Computed Properties
- Exact Mass: 240.10639
- Monoisotopic Mass: 240.10627659g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 1
- Complexity: 288
- 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: 3.8
- Topological Polar Surface Area: 31?2
Experimental Properties
- PSA: 30.95
1H-Indol-1-amine, 3-(4-fluorophenyl)-5-methyl- Related Literature
-
Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
-
Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
-
Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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