Cas no 681486-38-4 (Benzoic acid, 4-iodo, TMS)
Benzoic acid, 4-iodo, TMS structure
Product Name:Benzoic acid, 4-iodo, TMS
CAS No:681486-38-4
MF:C10H13IO2Si
MW:320.198996305466
CID:2798727
PubChem ID:529203
Update Time:2025-04-21
Benzoic acid, 4-iodo, TMS Chemical and Physical Properties
Names and Identifiers
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- 681486-38-4
- DTXSID70336121
- DTXCID20287210
- Benzoic acid, 4-iodo, TMS
- SCHEMBL5051772
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- Inchi： 1S/C10H13IO2Si/c1-14(2,3)13-10(12)8-4-6-9(11)7-5-8/h4-7H,1-3H3
- InChI Key： SXULXJCDUHIXPH-UHFFFAOYSA-N
- SMILES： IC1C=CC(=CC=1)C(=O)O[Si](C)(C)C
Computed Properties
- Exact Mass: 319.97295Da
- Monoisotopic Mass: 319.97295Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 205
- 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
- Topological Polar Surface Area: 26.3?2
Benzoic acid, 4-iodo, TMS Related Literature
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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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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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Raktani Bikshapathi,Sai Prathima Parvathaneni,Vaidya Jayathirtha Rao Green Chem., 2017,19, 4446-4450
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