Cas no 107941-22-0 (Naphthalene, 2-bromo-1,4,5-trimethoxy-)
107941-22-0 structure
Product Name:Naphthalene, 2-bromo-1,4,5-trimethoxy-
CAS No:107941-22-0
MF:C13H13BrO3
MW:297.144523382187
CID:1184925
PubChem ID:11022859
Update Time:2025-04-20
Naphthalene, 2-bromo-1,4,5-trimethoxy- Chemical and Physical Properties
Names and Identifiers
-
- Naphthalene, 2-bromo-1,4,5-trimethoxy-
- 2-bromo-1,4,5-trimethoxynaphthalene
- 2-bromo-1,4,5-trimethoxy-naphthalene
- DTXSID00452303
- DA-47996
- 107941-22-0
-
- Inchi： 1S/C13H13BrO3/c1-15-10-6-4-5-8-12(10)11(16-2)7-9(14)13(8)17-3/h4-7H,1-3H3
- InChI Key： AUILEPZSHAIIKS-UHFFFAOYSA-N
- SMILES： BrC1=CC(=C2C(=CC=CC2=C1OC)OC)OC
Computed Properties
- Exact Mass: 296.00479
- 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
Experimental Properties
- PSA: 27.69
Naphthalene, 2-bromo-1,4,5-trimethoxy- Related Literature
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Eunju Nam,Jiyeon Han,Sunhee Choi,Mi Hee Lim Chem. Commun., 2021,57, 7637-7640
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