Cas no 7134-14-7 (Benzenesulfonic acid, 2,5-dimethoxy-)
7134-14-7 structure
Product Name:Benzenesulfonic acid, 2,5-dimethoxy-
CAS No:7134-14-7
MF:C8H10O5S
MW:218.227001667023
CID:545689
PubChem ID:14317941
Update Time:2025-04-19
Benzenesulfonic acid, 2,5-dimethoxy- Chemical and Physical Properties
Names and Identifiers
-
- Benzenesulfonic acid, 2,5-dimethoxy-
- 2,5-dimethoxybenzenesulfonic acid
- 2,5-Dimethoxybenzene-1-sulfonic acid
- 7134-14-7
- SCHEMBL668653
- DTXSID30558842
-
- Inchi： 1S/C8H10O5S/c1-12-6-3-4-7(13-2)8(5-6)14(9,10)11/h3-5H,1-2H3,(H,9,10,11)
- InChI Key： YKPVMVVSUJOBHF-UHFFFAOYSA-N
- SMILES： S(C1C=C(C=CC=1OC)OC)(=O)(=O)O
Computed Properties
- Exact Mass: 218.0249
- Monoisotopic Mass: 218.02489459g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 268
- 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: 0.3
- Topological Polar Surface Area: 81.2?2
Experimental Properties
- PSA: 72.83
Benzenesulfonic acid, 2,5-dimethoxy- Related Literature
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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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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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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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