Cas no 500579-52-2 (2-Methyl-4,6,8-tribromoquinoline)
500579-52-2 structure
Product Name:2-Methyl-4,6,8-tribromoquinoline
CAS No:500579-52-2
MF:C10H6Br3N
MW:379.873340129852
CID:1004859
PubChem ID:282971
Update Time:2025-04-20
2-Methyl-4,6,8-tribromoquinoline Chemical and Physical Properties
Names and Identifiers
-
- 2-Methyl-4,6,8-tribromoquinoline
- 4,6,8-tribromo-2-methylquinoline
- NSC-137132
- MFCD11505152
- DB-261312
- NSC137132
- 500579-52-2
- DTXSID70300468
- AKOS025394707
-
- Inchi: 1S/C10H6Br3N/c1-5-2-8(12)7-3-6(11)4-9(13)10(7)14-5/h2-4H,1H3
- InChI Key: MXEWLOUDZHZIQF-UHFFFAOYSA-N
- SMILES: BrC1C=C(C)N=C2C(=CC(=CC2=1)Br)Br
Computed Properties
- Exact Mass: 376.80500
- Monoisotopic Mass: 376.80504g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 0
- Complexity: 212
- 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: 4.7
- Topological Polar Surface Area: 12.9?2
Experimental Properties
- PSA: 12.89000
- LogP: 4.83070
2-Methyl-4,6,8-tribromoquinoline Related Literature
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1. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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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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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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