Cas no 919800-56-9 (Naphthalene, 2-bromo-1,5,8-trimethoxy-)
919800-56-9 structure
Product Name:Naphthalene, 2-bromo-1,5,8-trimethoxy-
CAS No:919800-56-9
MF:C13H13BrO3
MW:297.144523382187
CID:760641
PubChem ID:71424702
Update Time:2025-04-19
Naphthalene, 2-bromo-1,5,8-trimethoxy- Chemical and Physical Properties
Names and Identifiers
-
- Naphthalene, 2-bromo-1,5,8-trimethoxy-
- 2-bromo-1,5,8-trimethoxynaphthalene
- DTXSID60843495
- 919800-56-9
-
- Inchi: 1S/C13H13BrO3/c1-15-10-6-7-11(16-2)12-8(10)4-5-9(14)13(12)17-3/h4-7H,1-3H3
- InChI Key: RVOREDVEMGRTMV-UHFFFAOYSA-N
- SMILES: BrC1C=CC2=C(C=CC(=C2C=1OC)OC)OC
Computed Properties
- Exact Mass: 296.00481g/mol
- Monoisotopic Mass: 296.00481g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 249
- 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: 3.8
- Topological Polar Surface Area: 27.7?2
Naphthalene, 2-bromo-1,5,8-trimethoxy- Related Literature
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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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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