Crinasiadine
Basic information
- CAS
40141-86-4- Standard SMILES
O=c1[nH]c2ccccc2c2cc3c(cc12)OCO3- InChIKey
NVOXRHIABFKYOT-UHFFFAOYSA-N- Molecular formula
- C14H9NO3
- Average molar mass
- 239.23 g/mol
- Monoisotopic mass
- 239.05824315
Overview
Crinasiadine is a member of phenanthridines.
Names & identifiers
- Preferred name
- Crinasiadine
- IUPAC
- 5H-[1,3]dioxolo[4,5-j]phenanthridin-6-one
- English name
- Crinasiadine
- Molecular formula
- C14H9NO3
- Molecular weight
- 239.22616
Names & synonyms
Crinasiadine40141-86-45H-[1,3]dioxolo[4,5-j]phenanthridin-6-oneC10583AC1L9DIHCTK1D6540CHEBI:3915SCHEMBL29633738DTXSID903319769H-[1,3]Dioxolo[4,5-j]phenanthridin-6(5H)-oneQ27106243
Database identifiers
- CAS
40141-86-4- PubChem CID
- 442850
- DTXSID
DTXSID90331976- ChEBI
CHEBI:3915- Nikkaji
- J2.078.307I
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 359
Chemistry & industry
Additional notes
DefinitionChEBI: Crinasiadine is a member of phenanthridines.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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