Cas no 53452-74-7 (Phosphonic acid, [(ethenylphenyl)methyl]-)
53452-74-7 structure
Product Name:Phosphonic acid, [(ethenylphenyl)methyl]-
CAS No:53452-74-7
MF:C9H11O3P
MW:198.155603647232
CID:336057
PubChem ID:22034605
Update Time:2025-04-19
Phosphonic acid, [(ethenylphenyl)methyl]- Chemical and Physical Properties
Names and Identifiers
-
- Phosphonic acid, [(ethenylphenyl)methyl]-
- (2-ethenylphenyl)methylphosphonic acid
- SCHEMBL966719
- DTXSID80621853
- 53452-74-7
- [(2-Ethenylphenyl)methyl]phosphonic acid
-
- Inchi: 1S/C9H11O3P/c1-2-8-5-3-4-6-9(8)7-13(10,11)12/h2-6H,1,7H2,(H2,10,11,12)
- InChI Key: YSZBJRZHRAWWHK-UHFFFAOYSA-N
- SMILES: P(CC1C=CC=CC=1C=C)(=O)(O)O
Computed Properties
- Exact Mass: 198.04458121g/mol
- Monoisotopic Mass: 198.04458121g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 221
- 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: 0.7
- Topological Polar Surface Area: 57.5?2
Phosphonic acid, [(ethenylphenyl)methyl]- Related Literature
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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