Basic information
- CAS
16002-30-5- Standard SMILES
COC(=O)CS(=O)(=O)CC(=O)OC- InChIKey
XWPWFILACZRQRM-UHFFFAOYSA-N- Molecular formula
- C6H10O6S
- Average molar mass
- 210.21 g/mol
- Monoisotopic mass
- 210.01980921
Names & identifiers
- Preferred name
- Acetic acid, 2,2'-sulfonylbis-, dimethyl ester
- IUPAC
- methyl 2-(2-methoxy-2-oxoethyl)sulfonylacetate
- English name
- Acetic acid, 2,2'-sulfonylbis-, 1,1'-dimethyl ester
- Molecular formula
- C6H10O6S
- Molecular weight
- 210.21
Names & synonyms
16002-30-5DTXSID30313392Acetic acid, 2,2'-sulfonylbis-, dimethyl esterRefChem:316379DTXCID70264516METHYL 2-(2-METHOXY-2-OXOETHANESULFONYL)ACETATEmethyl 2-(2-methoxy-2-oxoethyl)sulfonylacetateAcetic acid, 2,2'-sulfonylbis-, 1,1'-dimethyl estermethyl [(2-methoxy-2-oxoethyl)sulfonyl]acetateNSC269902SCHEMBL10622350Dimethyl 2,2'-sulfonyldiacetate
Show more names
METHOXYCARBONYLMETHANESULFONYL-ACETIC ACID METHYL ESTER
bis(methoxycarbonylmethyl) sulfoneXWPWFILACZRQRM-UHFFFAOYSA-NSBB094322AKOS009813394NSC-269902CS-0234131EN300-138881G54473
Database identifiers
- CAS
16002-30-5- PubChem CID
- 320830
- DTXSID
DTXSID30313392- Nikkaji
- J802.914H
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 95.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 261
Physicochemical properties
- Melting point
- 115.16 °C · 115.16 °C(Solv: water (7732-18-5))
- Boiling point
- 185 · 185-187 °C(Press: 10 Torr)
- Density
- 1.351 · 1.351±0.06 g/cm3(Predicted)
Chemistry & industry
Suppliers1 total
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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