6(5H)-Phenanthridinone
Properties
- Molecular formula
- C13H9NO
- Molar mass
- 195.22 g/mol
- Exact mass
- 195.0684 Da
- Melting point
- above 300 °C
- Boiling point
- 435 °C
- logP
- 3.09Crippen estimate
- Polar surface area
- 33.1 Ų
- H-bond donors / acceptors
- 1 / 2
- Rotatable bonds
- 0
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
1015-89-0SMILES
Oc1nc2ccccc2c2ccccc12InChIKey
RZFVLEJOHSLEFR-UHFFFAOYSA-NInChI
InChI=1S/C13H9NO/c15-13-11-7-2-1-5-9(11)10-6-3-4-8-12(10)14-13/h1-8H,(H,14,15)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
10 names
- 6-Phenanthridinol
- 6-Phenanthridone
- 6-Phenanthridinone
- PJ 97A
- 5H-Phenanthridin-6-one
- NSC 11021
- NSC 40943
- NSC 61083
- WD 99-004344
- Phenanthridinone
Work with 6(5H)-Phenanthridinone
Predict the NMR spectrum1H and 13C shifts with multiplicities
Make a solutionWhat to weigh for any molarity and volume
Check drug-likenessLipinski, Veber and lead-likeness
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
Quinazolinedione86-96-463 % similar
2-Mercapto-4(3H)-quinazolinone13906-09-759 % similar
2,3-Dihydro-1,4-phthalazinedione1445-69-854 % similar
Quinazolinone491-36-148 % similar
1,2,3-Benzotriazin-4-one90-16-448 % similar
Benzo[c]cinnoline230-17-146 % similar
2,4-Dihydroxyquinoline86-95-345 % similar
9-Chloroacridine1207-69-843 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds