Cas no 58096-06-3 (1-chloro-3-methyl-5H-Pyrido[4,3-b]indole)
![1-chloro-3-methyl-5H-Pyrido[4,3-b]indole structure](https://ossimg.kuujia.com/scimg/58500/58096-06-3x500.png)
58096-06-3 structure
Product Name:1-chloro-3-methyl-5H-Pyrido[4,3-b]indole
CAS No:58096-06-3
MF:C12H9ClN2
MW:216.666261434555
CID:1114387
PubChem ID:12255816
Update Time:2025-04-20
1-chloro-3-methyl-5H-Pyrido[4,3-b]indole Chemical and Physical Properties
Names and Identifiers
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- 1-chloro-3-methyl-5H-Pyrido[4,3-b]indole
- DB-354393
- 58096-06-3
-
- Inchi： 1S/C12H9ClN2/c1-7-6-10-11(12(13)14-7)8-4-2-3-5-9(8)15-10/h2-6,15H,1H3
- InChI Key： PDQROKIHSBVFGK-UHFFFAOYSA-N
- SMILES： ClC1C2=C(C=C(C)N=1)NC1C=CC=CC2=1
Computed Properties
- Exact Mass: 216.0454260g/mol
- Monoisotopic Mass: 216.0454260g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 15
- Rotatable Bond Count: 0
- Complexity: 246
- 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: 3.7
- Topological Polar Surface Area: 28.7?2
1-chloro-3-methyl-5H-Pyrido[4,3-b]indole Related Literature
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1. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
58096-06-3 (1-chloro-3-methyl-5H-Pyrido[4,3-b]indole) Related Products
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