Cas no 113385-63-0 (3-bromo-1-(dibromomethyl)isoquinoline)
113385-63-0 structure
Product Name:3-bromo-1-(dibromomethyl)isoquinoline
CAS No:113385-63-0
MF:C10H6Br3N
MW:379.873340129852
CID:2610630
PubChem ID:13865357
Update Time:2025-04-21
3-bromo-1-(dibromomethyl)isoquinoline Chemical and Physical Properties
Names and Identifiers
-
- 3-bromo-1-(dibromomethyl)isoquinoline
- 113385-63-0
- DTXSID50551512
-
- Inchi： 1S/C10H6Br3N/c11-8-5-6-3-1-2-4-7(6)9(14-8)10(12)13/h1-5,10H
- InChI Key： VKYJKBNBIBQQAH-UHFFFAOYSA-N
- SMILES： BrC(C1C2C=CC=CC=2C=C(N=1)Br)Br
Computed Properties
- Exact Mass: 378.80299Da
- Monoisotopic Mass: 376.80504Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 198
- 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: 4.6
- Topological Polar Surface Area: 12.9?2
3-bromo-1-(dibromomethyl)isoquinoline Related Literature
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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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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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
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5. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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