Basic information
- CAS
55791-06-5- Standard SMILES
CS(=O)(=O)OCc1ccccc1- InChIKey
ZDKRMIJRCHPKLW-UHFFFAOYSA-N- Molecular formula
- C8H10O3S
- Average molar mass
- 186.23 g/mol
- Monoisotopic mass
- 186.03506518
Overview
structure in first source
Names & identifiers
- Preferred name
- Benzyl mesylate
- IUPAC
- benzyl methanesulfonate
- English name
- Phenylmethyl methanesulfonate
- Molecular formula
- C8H10O3S
- Molecular weight
- 186.23
Names & synonyms
benzyl mesylateRefChem:916987benzyl methanesulfonate55791-06-5METHYLSULFONYLOXYMETHYLBENZENEMethanesulfonic acid, phenylmethyl esterMFCD25964568Phenylmethyl methanesulfonatemethanesulfonic acid benzyl esterSCHEMBL249386SCHEMBL4334012SCHEMBL9503437
Show more names
SCHEMBL9586655DTXSID80204362ZDKRMIJRCHPKLW-UHFFFAOYSA-NAKOS026732519SY311273G71480
Database identifiers
- CAS
55791-06-5- PubChem CID
- 148757
- DTXSID
DTXSID80204362- Nikkaji
- J1.129.922I
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 51.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 209
Physicochemical properties
- Boiling point
- 98 °C · 98 °C(Press: 0.2 Torr)
- Density
- 1.244 · 1.244±0.06 g/cm3(Predicted)
- storage temp.
- Store at room temperature
- Appearance
- Light yellow to light brown Oil
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers34 total
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
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怀化元研达生物技术有限责任公司18711085600 · [email protected]
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苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
怀化元研达生物技术有限责任公司18711085600; 18229999901 · [email protected]
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Shaanxi Dideu New Materials Co. Ltd18192503167 · [email protected]
广州佳途科技股份有限公司020-81960175-877 18933936954 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
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江苏艾康生物医药研发有限公司025-58859352 18651614124 · [email protected]
北京海特乐思克科技有限公司15210893940; 15116916250 · [email protected]
河南卓凡化工有限公司15638881523 · [email protected]
郑州灵之悦科技有限公司+86-0371-55074660 · [email protected]
Related reactions
13 records
Compound notes
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