Basic information
- CAS
93033-99-9- Standard SMILES
CC(=O)Oc1cc2c3c(c1)CCCN3CCC2- InChIKey
GPVVHKXOTQDZOK-UHFFFAOYSA-N- Molecular formula
- C14H17NO2
- Average molar mass
- 231.29 g/mol
- Monoisotopic mass
- 231.12592879
Names & identifiers
- Preferred name
- 9-Acetoxyjulolidine
- IUPAC
- 1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-yl acetate
Names & synonyms
9-AcetoxyjulolidineNSC 159998AW3LR7SY2K1H,5H-Benzo(ij)quinolizin-9-ol, 2,3,6,7-tetrahydro-, acetate93033-99-9BRN 5954551UNII-AW3LR7SY2KNSC-1599982,3,6,7-Tetrahydro-1H,5H-benzo(ij)quinolizin-9-ol acetateDTXSID30239245NSC-1599971H,5H-BENZO(IJ)QUINOLIZIN-9-OL, 2,3,6,7-TETRAHYDRO-, 9-ACETATE
Show more names
1H,5H-BENZO(IJ)QUINOLIZIN-9-OL, 2,3,6,7-TETRAHYDRO-, ACETATE (ESTER)RefChem:199273DTXCID50161736NSC1599982,3,6,7-Tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-yl acetate
Database identifiers
- CAS
93033-99-9- PubChem CID
- 98699
- DTXSID
DTXSID30239245- UNII
- AW3LR7SY2K
- Nikkaji
- J65.468J
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 285
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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