Basic information
- CAS
61691-83-6- Standard SMILES
C=CC(OC(C)=O)c1ccc(OC)c2ccccc12- InChIKey
KVDKMCOTAUKHLC-UHFFFAOYSA-N- Molecular formula
- C16H16O3
- Average molar mass
- 256.3 g/mol
- Monoisotopic mass
- 256.10994437
Names & identifiers
- Preferred name
- 1'-Acetoxy-1-allyl-4-methoxynaphthalene
- IUPAC
- 1-(4-methoxynaphthalen-1-yl)prop-2-enyl acetate
Names & synonyms
1'-Acetoxy-1-allyl-4-methoxynaphthalene61691-83-6alpha-Ethenyl-4-methoxy-1-naphthalenemethanol acetate3KJ64G49EN1-NAPHTHALENEMETHANOL, 4-METHOXY-alpha-VINYL-, ACETATE4-Methoxy-alpha-vinyl-1-naphthalenemethanol acetate1-Naphthalenemethanol, alpha-ethenyl-4-methoxy-, acetateUNII-3KJ64G49ENDTXSID409772621-(4-methoxynaphthalen-1-yl)prop-2-en-1-yl acetateQ278943771-NAPHTHALENEMETHANOL, .ALPHA.-ETHENYL-4-METHOXY-, 1-ACETATE
Database identifiers
- CAS
61691-83-6- PubChem CID
- 43716
- DTXSID
DTXSID40977262- UNII
- 3KJ64G49EN
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 326
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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