Basic information
- CAS
25236-60-6- Standard SMILES
CS(=O)(=O)OC12CC3CC(CC(C3)C1)C2- InChIKey
DHINVMZVWZGDAB-UHFFFAOYSA-N- Molecular formula
- C11H18O3S
- Average molar mass
- 230.33 g/mol
- Monoisotopic mass
- 230.09766561
Names & identifiers
- Preferred name
- 1-Adamantyl methanesulfonate
- IUPAC
- 1-adamantyl methanesulfonate
- English name
- Methyl 1-adamantanesulfonate
- Molecular formula
- C11H18O3S
- Molecular weight
- 230.32
Names & synonyms
1-adamantyl methanesulfonate25236-60-6DTXSID70301511RefChem:227381DTXCID20252645ADAMANTAN-1-YL METHANESULFONATETricyclo[3.3.1.13,7]decan-1-ol, methanesulfonateadamantane mesylateNSC143918Maybridge1_004071SCHEMBL3422066SCHEMBL13608630
Show more names
Tricyclo[3.3.1.13,7]decan-1-ol, 1-methanesulfonate
HMS553B03MFCD02677760AKOS024318995NSC-143918ADAMANTANE-1-SULFONIC ACID METHYL ESTER
Database identifiers
- CAS
25236-60-6- PubChem CID
- 286103
- DTXSID
DTXSID70301511- Nikkaji
- J293.099D
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 51.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 325
Physicochemical properties
- Melting point
- 114 · 114-116 °C(lit.)
- WGK Germany
- 3 · 3
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- 3
Chemistry & industry
Suppliers1 total
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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