Cas no 53462-79-6 (4-ethyl-1,3,4,5-tetrahydropyrrolo[4,3,2-de]isoquinoline hydrochloride)
![4-ethyl-1,3,4,5-tetrahydropyrrolo[4,3,2-de]isoquinoline hydrochloride structure](https://ossimg.kuujia.com/scimg/53500/53462-79-6x500.png)
53462-79-6 structure
Product Name:4-ethyl-1,3,4,5-tetrahydropyrrolo[4,3,2-de]isoquinoline hydrochloride
CAS No:53462-79-6
MF:C12H15ClN2
MW:222.713901758194
CID:1582722
PubChem ID:3041102
Update Time:2025-04-21
4-ethyl-1,3,4,5-tetrahydropyrrolo[4,3,2-de]isoquinoline hydrochloride Chemical and Physical Properties
Names and Identifiers
-
- 4-ethyl-1,3,4,5-tetrahydropyrrolo[4,3,2-de]isoquinoline hydrochloride
- 4-Ethyl-1,3,4,5-tetrahydropyrrolo(4,3,2-de)isoquinoline hydrochloride
- 1,3,4,5-Tetrahydro-4-ethyl-pyrrolo(4,3,2-de)isoquinoline hydrochloride
- Pyrrolo(4,3,2-de)isoquinoline, 1,3,4,5-tetrahydro-4-ethyl-, monohydrochloride
- DTXSID70201648
- 53462-79-6
- SCHEMBL11867318
-
- Inchi： 1S/C12H14N2.ClH/c1-2-14-7-9-4-3-5-11-12(9)10(8-14)6-13-11;/h3-6,13H,2,7-8H2,1H3;1H
- InChI Key： IFGMXTVMYFFZFM-UHFFFAOYSA-N
- SMILES： Cl.N1(CC)CC2C=CC=C3C=2C(=CN3)C1
Computed Properties
- Exact Mass: 222.09255
- Monoisotopic Mass: 222.0923762g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 216
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 19?2
Experimental Properties
- PSA: 19.03
4-ethyl-1,3,4,5-tetrahydropyrrolo[4,3,2-de]isoquinoline hydrochloride Related Literature
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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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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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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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Jason Wan Lab Chip, 2020,20, 4528-4538
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