Cas no 62236-21-9 (1H-Indole, 3-(4-chlorophenyl)-2,3-dihydro-)
62236-21-9 structure
Product Name:1H-Indole, 3-(4-chlorophenyl)-2,3-dihydro-
CAS No:62236-21-9
MF:C14H12ClN
MW:229.704782485962
CID:453104
PubChem ID:53732316
Update Time:2025-04-19
1H-Indole, 3-(4-chlorophenyl)-2,3-dihydro- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Indole, 3-(4-chlorophenyl)-2,3-dihydro-
- 3-(4-chlorophenyl)-2,3-dihydro-1H-indole
- 3-p-chlorophenylindoline
- SCHEMBL11516181
- COSXUZXLIOCXMU-UHFFFAOYSA-N
- 62236-21-9
- DTXSID00706272
-
- Inchi： 1S/C14H12ClN/c15-11-7-5-10(6-8-11)13-9-16-14-4-2-1-3-12(13)14/h1-8,13,16H,9H2
- InChI Key： COSXUZXLIOCXMU-UHFFFAOYSA-N
- SMILES： ClC1C=CC(=CC=1)C1C2C=CC=CC=2NC1
Computed Properties
- Exact Mass: 229.06596
- Monoisotopic Mass: 229.066
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 16
- Rotatable Bond Count: 1
- Complexity: 235
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4
- Topological Polar Surface Area: 12?2
Experimental Properties
- PSA: 12.03
1H-Indole, 3-(4-chlorophenyl)-2,3-dihydro- Related Literature
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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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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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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