Basic information
- CAS
16586-43-9- Standard SMILES
CCN(CCC#N)c1ccc(N=Nc2ccc([N+](=O)[O-])cc2Cl)c(C)c1- InChIKey
BHOOSPBGGKYHCM-UHFFFAOYSA-N- Molecular formula
- C18H18ClN5O2
- Average molar mass
- 371.8 g/mol
- Monoisotopic mass
- 371.1149025
Names & identifiers
- Preferred name
- 3-((4-((2-Chloro-4-nitrophenyl)azo)-3-methylphenyl)ethylamino)propiononitrile
- IUPAC
- 3-[4-[(2-chloro-4-nitrophenyl)diazenyl]-N-ethyl-3-methylanilino]propanenitrile
- English name
- 3-[[4-[(2-chloro-4-nitrophenyl)azo]-3-methylphenyl]ethylamino]propiononitrile
- Molecular formula
- C18H18ClN5O2
- Molecular weight
- 371.82
Names & synonyms
DISPERSE RED 653-[[4-[(2-Chloro-4-nitrophenyl)azo]-3-methylphenyl]ethylamino]propiononitrilePropanenitrile, 3-((4-((2-chloro-4-nitrophenyl)azo)-3-methylphenyl)ethylamino)-3-((4-((2-Chloro-4-nitrophenyl)azo)-3-methylphenyl)ethylamino)propiononitrilePropanenitrile, 3-((4-(2-(2-chloro-4-nitrophenyl)diazenyl)-3-methylphenyl)ethylamino)-Propanenitrile, 3-[[4-[(2-chloro-4-nitrophenyl)azo]-3-methylphenyl]ethylamino]-Propanenitrile, 3-[[4-[2-(2-chloro-4-nitrophenyl)diazenyl]-3-methylphenyl]ethylamino]-RefChem:488495Propanenitrile, 3-4-(2-chloro-4-nitrophenyl)azo-3-methylphenylethylamino-240-641-516586-43-9Disperse Red N
Show more names
C.I.11228Ambicet Red MGResolin Red GRSelapers Red GRPolycron Red BCWTertranese Red P-MGTriasperse Red FL-SSerilene Dark Red FLDisperse Scarlet S-GR
12223-38-03-[4-[(2-chloro-4-nitrophenyl)diazenyl]-N-ethyl-3-methylanilino]propanenitrile3-4-(2-Chloro-4-nitrophenyl)azo-3-methylphenylethylaminopropiononitrileEINECS 240-641-5C.I. Disperse Red 65BHOOSPBGGKYHCM-UHFFFAOYSA-N3-(4-((2-Chloro-4-nitrophenyl)azo)-N-ethyl-m-toluidino)propionitrileBenzenamine, 4-(((2-chloro-4-nitro)phenyl)azo)-3-methyl-N-(2-cyanoethyl)-N-ethyl-
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 97.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 543
Physicochemical properties
- Boiling point
- 589.4 · 589.4±50.0 °C(Predicted)
- Density
- 1.25 · 1.25±0.1 g/cm3(Predicted)
- pka
- 2.28 · 2.28±0.50(Predicted)
- EPA Substance Registry System
- 3 · Propanenitrile, 3-[[4-[(2-chloro-4-nitrophenyl)azo]-3-methylphenyl]ethylamino]- (16586-43-9)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (23 of 23) of all reports.
Not Classified
Aggregated GHS information provided per 23 reports by companies from 2 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory Information
Chemical: Propanenitrile, 3-[[4-[(2-chloro-4-nitrophenyl)azo]-3-methylphenyl]ethylamino]-
Propanenitrile, 3-4-(2-chloro-4-nitrophenyl)azo-3-methylphenylethylamino-: 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.
Hazard Classes and CategoriesNot Classified
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationPropanenitrile, 3-[[4-[2-(2-chloro-4-nitrophenyl)diazenyl]-3-methylphenyl]ethylamino]-: ACTIVE
Applications
UsesDisperse red 65 is a red dye derived from anthraquinone. It is used in plastics, textiles and cosmetics.
Upstream & downstream products
Upstream raw materials
Suppliers1 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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