Cas no 827045-00-1 (Benzenemethanol, 2,5-diiodo-4-methyl-)
827045-00-1 structure
Product Name:Benzenemethanol, 2,5-diiodo-4-methyl-
CAS No:827045-00-1
MF:C8H8I2O
MW:373.957467079163
CID:685739
PubChem ID:71417687
Update Time:2025-04-19
Benzenemethanol, 2,5-diiodo-4-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzenemethanol, 2,5-diiodo-4-methyl-
- (2,5-diiodo-4-methylphenyl)methanol
- DTXSID70837022
- 827045-00-1
-
- Inchi： 1S/C8H8I2O/c1-5-2-8(10)6(4-11)3-7(5)9/h2-3,11H,4H2,1H3
- InChI Key： RUAZJSWLQUOTBJ-UHFFFAOYSA-N
- SMILES： IC1C=C(C)C(=CC=1CO)I
Computed Properties
- Exact Mass: 373.86646g/mol
- Monoisotopic Mass: 373.86646g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 129
- 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: 2.7
- Topological Polar Surface Area: 20.2?2
Benzenemethanol, 2,5-diiodo-4-methyl- Related Literature
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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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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