Cas no 90679-08-6 (5-(4-Pyridinyl)indoline)
5-(4-Pyridinyl)indoline structure
Product Name:5-(4-Pyridinyl)indoline
CAS No:90679-08-6
MF:C13H12N2
MW:196.247782707214
CID:2812581
PubChem ID:13276696
Update Time:2025-04-21
5-(4-Pyridinyl)indoline Chemical and Physical Properties
Names and Identifiers
-
- DTXSID90534046
- 5-(4-pyridinyl)indoline
- SCHEMBL4525557
- AKOS011790231
- DAQYEMLWVIQCRV-UHFFFAOYSA-N
- 5-(Pyridin-4-yl)-2,3-dihydro-1H-indole
- 5-(Pyridin-4-yl)indoline
- 90679-08-6
- 5-(4-Pyridinyl)indoline
-
- Inchi： 1S/C13H12N2/c1-2-13-12(5-8-15-13)9-11(1)10-3-6-14-7-4-10/h1-4,6-7,9,15H,5,8H2
- InChI Key： DAQYEMLWVIQCRV-UHFFFAOYSA-N
- SMILES： N1C2C=CC(C3C=CN=CC=3)=CC=2CC1
Computed Properties
- Exact Mass: 196.100048391Da
- Monoisotopic Mass: 196.100048391Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 211
- 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: 24.9?2
5-(4-Pyridinyl)indoline Related Literature
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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