Methyl 3-methoxyadamantane-1-carboxylate
Basic information
- CAS
103549-37-7- Standard SMILES
COC(=O)C12CC3CC(CC(OC)(C3)C1)C2- InChIKey
CWOBWCDFHUNRGG-UHFFFAOYSA-N- Molecular formula
- C13H20O3
- Average molar mass
- 224.3 g/mol
- Monoisotopic mass
- 224.1412445
Names & identifiers
- Preferred name
- Methyl 3-methoxyadamantane-1-carboxylate
- IUPAC
- methyl 3-methoxyadamantane-1-carboxylate
Names & synonyms
103549-37-73-Methoxytricyclo(3.3.1.13,7decane-1-carboxylic acid, methyl estermethyl 3-methoxyadamantane-1-carboxylate3-Methoxytricyclo[3.3.1.13,7decane-1-carboxylic acid, methyl esterSCHEMBL26017392DTXSID70908468
Database identifiers
- CAS
103549-37-7- PubChem CID
- 145398
- DTXSID
DTXSID70908468
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 309
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…