Basic information
- CAS
18484-32-7- Standard SMILES
CC(OC(=O)CCC(=O)O)C12CC3CC(CC(C3)C1)C2- InChIKey
HCTVUXYVRWXMGI-UHFFFAOYSA-N- Molecular formula
- C16H24O4
- Average molar mass
- 280.36 g/mol
- Monoisotopic mass
- 280.16745925
Names & identifiers
- Preferred name
- Succinic acid, mono(1-(1-adamantyl)ethyl) ester
- IUPAC
- 4-[1-(1-adamantyl)ethoxy]-4-oxobutanoic acid
- English name
- Succinic acid hydrogen 1-[1-(1-adamantyl)ethyl] ester
- Molecular weight
- 0
Names & synonyms
18484-32-71-Adamantilmetilcarbinolo, emisuccinato [Italian]Succinic acid, mono(1-(1-adamantyl)ethyl) ester1-Adamantilmetilcarbinolo, emisuccinatoRefChem:3824104-[1-(1-adamantyl)ethoxy]-4-oxobutanoic acid4-(1-(Adamantan-1-yl)ethoxy)-4-oxobutanoic acid4-[1-(Adamantan-1-yl)ethoxy]-4-oxobutanoic acidSuccinic acid hydrogen 1-[1-(1-adamantyl)ethyl] esterDTXSID40939901
Database identifiers
- CAS
18484-32-7- PubChem CID
- 64178
- DTXSID
DTXSID40939901- Nikkaji
- J90.564J
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 63.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 373
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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