Cas no 887406-47-5 (4-(Hydroxymethyl)benzyl Methanethiosulfonate)
887406-47-5 structure
Product Name:4-(Hydroxymethyl)benzyl Methanethiosulfonate
CAS No:887406-47-5
MF:C9H12O3S2
MW:232.319780349731
CID:827038
PubChem ID:4157533
Update Time:2025-04-19
4-(Hydroxymethyl)benzyl Methanethiosulfonate Chemical and Physical Properties
Names and Identifiers
-
- 4-(Hydroxymethyl)benzyl Methanethiosulfonate
- [4-(methylsulfonylsulfanylmethyl)phenyl]methanol
- Methanesulfonothioic Acid S-[[4-(Hydroxymethyl)phenyl]methyl] Ester
- MTSHMB
- 887406-47-5
- AKOS030239654
- FT-0669766
- DTXSID50400056
-
- Inchi： 1S/C9H12O3S2/c1-14(11,12)13-7-9-4-2-8(6-10)3-5-9/h2-5,10H,6-7H2,1H3
- InChI Key： GMXLIEXWALUYMT-UHFFFAOYSA-N
- SMILES： S(C)(=O)(=O)SCC1C=CC(CO)=CC=1
Computed Properties
- Exact Mass: 232.02300
- Monoisotopic Mass: 232.02278659g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 4
- Complexity: 248
- 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: 0.6
- Topological Polar Surface Area: 88?2
Experimental Properties
- Density: 1.4±0.1 g/cm3
- Melting Point: 77-79°C
- Boiling Point: 461.8±33.0 °C at 760 mmHg
- Flash Point: 233.1±25.4 °C
- Solubility: Acetone, Chloroform, Dichloromethane, Ethanol, Methanol
- PSA: 88.05000
- LogP: 2.45250
- Vapor Pressure: 0.0±1.2 mmHg at 25°C
4-(Hydroxymethyl)benzyl Methanethiosulfonate Security Information
- Signal Word：warning
- Hazard Statement： H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body
- Warning Statement： P264+P280+P305+P351+P338+P337+P313
- Safety Instruction： H303+H313+H333
- Storage Condition：-20?°C Freezer
4-(Hydroxymethyl)benzyl Methanethiosulfonate Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | H946440-5mg |
4-(Hydroxymethyl)benzyl Methanethiosulfonate |
887406-47-5 | 5mg |
$ 127.00 | 2023-09-07 | ||
| TRC | H946440-10mg |
4-(Hydroxymethyl)benzyl Methanethiosulfonate |
887406-47-5 | 10mg |
$ 173.00 | 2023-09-07 | ||
| TRC | H946440-25mg |
4-(Hydroxymethyl)benzyl Methanethiosulfonate |
887406-47-5 | 25mg |
$ 431.00 | 2023-09-07 | ||
| TRC | H946440-50mg |
4-(Hydroxymethyl)benzyl Methanethiosulfonate |
887406-47-5 | 50mg |
$787.00 | 2023-05-18 | ||
| TRC | H946440-100mg |
4-(Hydroxymethyl)benzyl Methanethiosulfonate |
887406-47-5 | 100mg |
$1355.00 | 2023-05-18 |
4-(Hydroxymethyl)benzyl Methanethiosulfonate Related Literature
-
Wenjie Zhao,Hua Hou,Yuchun Jin,Zhixiang Zeng,Xuedong Wu,Qunji Xue RSC Adv., 2014,4, 60307-60315
-
Mei-Yu Xu,Ya-Ting Wang,Qing-Ling Ni,Zi-Hao Zhang,Guang-Ming Liang,Liu-Cheng Gui Dalton Trans., 2016,45, 4993-4997
-
Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
-
Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
-
Eunice Y.-L. Hui,Bhimsen Rout,Yaw Sing Tan,Kok-Ping Chan,Charles W. Johannes Org. Biomol. Chem., 2018,16, 389-392
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