Cas no 91718-21-7 (1-Iodo-2-(phenoxymethyl)benzene)
91718-21-7 structure
Product Name:1-Iodo-2-(phenoxymethyl)benzene
CAS No:91718-21-7
MF:C13H11IO
MW:310.130316019058
CID:2814212
PubChem ID:69617043
Update Time:2025-04-21
1-Iodo-2-(phenoxymethyl)benzene Chemical and Physical Properties
Names and Identifiers
-
- SCHEMBL5947507
- 1-Iodo-2-(phenoxymethyl)benzene
- Benzene, 1-iodo-2-(phenoxymethyl)-
- DTXSID10741013
- A1-05122
- 91718-21-7
-
- Inchi： 1S/C13H11IO/c14-13-9-5-4-6-11(13)10-15-12-7-2-1-3-8-12/h1-9H,10H2
- InChI Key： NAFBGMQXEJNQNU-UHFFFAOYSA-N
- SMILES： IC1C=CC=CC=1COC1C=CC=CC=1
Computed Properties
- Exact Mass: 309.98546Da
- Monoisotopic Mass: 309.98546Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 177
- 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
- Topological Polar Surface Area: 9.2?2
1-Iodo-2-(phenoxymethyl)benzene Related Literature
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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Yu Long,Bing Yuan,Jianrui Niu,Xin Tong,Jiantai Ma New J. Chem., 2015,39, 1179-1185
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
91718-21-7 (1-Iodo-2-(phenoxymethyl)benzene) Related Products
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