Basic information
- Standard SMILES
C=CCC1(C(=O)OC)CCc2cc(C(=O)OC)ccc2C1- InChIKey
DRWOOUOGIJRWMU-UHFFFAOYSA-N- Molecular formula
- C17H20O4
- Average molar mass
- 288.34 g/mol
- Monoisotopic mass
- 288.13615911
Names & identifiers
- Preferred name
- (+/-)-Dimethyl 2-allyl-1,2,3,4-tetrahydronaphthalene-2,6-dicarboxylate
- IUPAC
- dimethyl 2-prop-2-enyl-3,4-dihydro-1H-naphthalene-2,6-dicarboxylate
Names & synonyms
SCHEMBL2767143DRWOOUOGIJRWMU-UHFFFAOYSA-N(+/-)-Dimethyl 2-allyl-1,2,3,4-tetrahydronaphthalene-2,6-dicarboxylate
Database identifiers
- PubChem CID
- 67526596
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 417
Related reactions
3 records
Compound notes
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