Basic information
- CAS
6829-22-7- Standard SMILES
O=c1c2cccc3cccc(c32)c2nc3cccc4cccc(c43)n12- InChIKey
NIDFGXDXQKPZMA-UHFFFAOYSA-N- Molecular formula
- C22H12N2O
- Average molar mass
- 320.3 g/mol
- Monoisotopic mass
- 320.094963
Names & identifiers
- Preferred name
- 14H-benz[4,5]isoquino[2,1-a]perimidin-14-one
- IUPAC
- 2,14-diazahexacyclo[13.7.1.14,8.02,13.019,23.012,24]tetracosa-1(22),4,6,8(24),9,11,13,15,17,19(23),20-undecaen-3-one
- English name
- Transparent Red E2G
- Molecular formula
- C22H12N2O
- Molecular weight
- 320.34
Names & synonyms
Show more names
Database identifiers
- CAS
6829-22-7、89106-94-5- PubChem CID
- 81271
- DTXSID
DTXSID8064482- EC Number
- 229-904-5、618-241-0
- Nikkaji
- J298.129G
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 613
Experimental & physicochemical properties
Physicochemical properties
- Melting point
- 253 °C · 253 °C
- Boiling point
- 611.6 · 611.6±38.0 °C(Predicted)
- Density
- 1.4 · 1.40±0.1 g/cm3(Predicted)
- vapor pressure
- 0 Pa · 0Pa at 25℃
- pka
- -2.59 · -2.59±0.20(Predicted)
- Water Solubility
- 11 μg/L · 11μg/L at 20℃
- LogP
- 5.5 at · 5.5 at 22℃
- EWG's Food Scores
- 1 · 1
- EPA Substance Registry System
- 14 H-Benz[4,5]isoquino[2,1-a]perimidin-14-one · 14H-Benz[4,5]isoquino[2,1-a]perimidin-14-one (6829-22-7)
- Symbol(GHS)
- 7 · GHS07,GHS02
- Signal word
- Warning
- Hazard statements
- 302 · H302+H312+H332-H315-H319-H226
- Precautionary statements
- 501 · P501-P261-P270-P240-P210-P233-P243-P241-P242-P271-P264-P280-P370+P378-P337+P313-P305+P351+P338-P362+P364-P303+P361+P353-P332+P313-P301+P312+P330-P304+P340+P312-P403+P235
- TSCA
- TSCA listed
- HS Code
- 2933399990 · 2933399990
- REACH Registrations
- Active
Safety & regulation
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 5.7% (211 of 3676) of reports.
Warning
H319 (90.2%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)
Aggregated GHS information provided per 3676 reports by companies from 6 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory Information
Chemical: 14H-Benz[4,5]isoquino[2,1-a]perimidin-14-one
Status: Active Update: 21-12-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/21766
14H-Benz4,5isoquino2,1-aperimidin-14-one: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Safety data
- tsca
- TSCA listed
- hs_code
- 2933399990
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS02
- Hazard statements
- H302+H312+H332-H315-H319-H226
- REACH Registrations
- Active
- Precautionary statements
- P501-P261-P270-P240-P210-P233-P243-P241-P242-P271-P264-P280-P370+P378-P337+P313-P305+P351+P338-P362+P364-P303+P361+P353-P332+P313-P301+P312+P330-P304+P340+P312-P403+P235
Chemistry & industry
Uses & manufacturing
Applications
UsesC.I. Solvent red 179 is the most important colorant used to add color or change the color of something and is chemically essentially unaffected by the carrier or medium into which it is incorporated. It can be widely used in textile, medicine, food, cosmetics, plastics, paint, ink, photography and paper industries.
Upstream & downstream products
Upstream raw materials
Suppliers44 total
Related reactions
Compound notes
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