Basic information
- CAS
12041-95-1- Standard SMILES
c1ccc2nc3ccc4ccccc4c3cc2c1- InChIKey
JEGZRTMZYUDVBF-UHFFFAOYSA-N- Molecular formula
- C17H11N
- Average molar mass
- 229.27 g/mol
- Monoisotopic mass
- 229.08914936
Overview
Benz[a]acridine is an organonitrogen heterocyclic compound and a polycyclic heteroarene.
Names & identifiers
- Preferred name
- Benz(a)acridine
- IUPAC
- benzo[a]acridine
- English name
- benzacridine
- Molecular formula
- C21H13N
- Molecular weight
- 229.27594
Names & synonyms
Benz[a]acridine225-11-61,2-BenzacridineBENZ(A)ACRIDINE7-Azabenz(a)anthraceneD4Q8MR98LUDTXSID9075371RefChem:561281DTXCID0036710205-929-7Benzo(a)acridinebenzo[a]acridine
Show more names
naphthacridine
BenzacridineBENZ (a) ACRIDINE (purity)85495-86-9CCRIS 2466EINECS 205-929-7UNII-D4Q8MR98LUBRN 0009262Debenzolyation
Database identifiers
- CAS
12041-95-1、225-11-6- PubChem CID
- 9180
- DTXSID
DTXSID9075371- ChEBI
CHEBI:82397- UNII
- D4Q8MR98LU
- EC Number
- 205-929-7
- Nikkaji
- J38.204C
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 300
Experimental & physicochemical properties
SpringerMaterials PropertiesAngular frequency
LogP4.27
Safety & regulation
GHS classification
GHS Classification
Warning
H400 (92.3%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
P273, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 13 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAquatic Acute 1 (92.3%)
Toxicology
Carcinogen Classification
Benz[a]acridine
Group 3: Not classifiable as to its carcinogenicity to humans
Volume 32: (1983) Polynuclear Aromatic Compounds, Part 1: Chemical, Environmental and Experimental Data
2013
2011
Chemistry & industry
Suppliers3 total
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Additional notes
DefinitionChEBI: Benz[a]acridine is an organonitrogen heterocyclic compound and a polycyclic heteroarene.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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