Basic information
- CAS
75198-96-8- Standard SMILES
CCN(CC)c1ccc(N=Nc2c(C#N)cc(C)cc2C#N)c(C)c1- InChIKey
JZTRIZGUGUEXRN-UHFFFAOYSA-N- Molecular formula
- C20H21N5
- Average molar mass
- 331.4 g/mol
- Monoisotopic mass
- 331.17969569
Names & identifiers
- Preferred name
- 1,3-Benzenedicarbonitrile, 2-[2-[4-(diethylamino)-2-methylphenyl]diazenyl]-5-methyl-
- IUPAC
- 2-[[4-(diethylamino)-2-methylphenyl]diazenyl]-5-methylbenzene-1,3-dicarbonitrile
- English name
- 2-[[4-(diethylamino)-2-methylphenyl]azo]-5-methylbenzene-1,3-dicarbonitrile
- Molecular formula
- C20H21N5
- Molecular weight
- 331.41
Names & synonyms
EINECS 278-104-22-[[4-(diethylamino)-2-methylphenyl]azo]-5-methylbenzene-1,3-dicarbonitrileDTXSID50728064-((2,6-Dicyano-4-methylphenyl)azo)-3-methyl-N,N-diethylbenzenamine1,3-Benzenedicarbonitrile, 2-((4-(diethylamino)-2-methylphenyl)azo)-5-methyl-1,3-Benzenedicarbonitrile, 2-[[4-(diethylamino)-2-methylphenyl]azo]-5-methyl-2-((4-(Diethylamino)-2-methylphenyl)azo)-5-methylbenzene-1,3-dicarbonitrile1,3-Benzenedicarbonitrile, 2-(2-(4-(diethylamino)-2-methylphenyl)diazenyl)-5-methyl-1,3-Benzenedicarbonitrile, 2-[2-[4-(diethylamino)-2-methylphenyl]diazenyl]-5-methyl-RefChem:412884DTXCID4047755278-104-2
Show more names
[(2,6-dicyano-4-methylphenyl)azo]-3-methyldiethylbenzamine2-[4-(Diethylamino)-2-methylphenylazo]-5-methylisophthalonitrile2-((4-(DIETHYLAMINO)-2-METHYLPHENYL)AZO)-5-METHYL-1,3-BENZENEDICARBONITRILE
75198-96-8SCHEMBL13904643JZTRIZGUGUEXRN-UHFFFAOYSA-NNS000376892-{[4-(Diethylamino)-2-methylphenyl]diazenyl}-5-methylbenzene-1,3-dicarbonitrile
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 75.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 523
Physicochemical properties
- Boiling point
- 545.3 · 545.3±50.0 °C(Predicted)
- Density
- 1.07 · 1.07±0.1 g/cm3(Predicted)
- pka
- 3.55 · 3.55±0.50(Predicted)
- EPA Substance Registry System
- 1 · 1,3-Benzenedicarbonitrile, 2-[[4-(diethylamino)-2-methylphenyl]azo]-5-methyl- (75198-96-8)
- 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% (40 of 40) of all reports.
Not Classified
Aggregated GHS information provided per 40 reports by companies from 2 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory Information
Chemical: 1,3-Benzenedicarbonitrile, 2-[[4-(diethylamino)-2-methylphenyl]azo]-5-methyl-
1,3-Benzenedicarbonitrile, 2-[2-[4-(diethylamino)-2-methylphenyl]diazenyl]-5-methyl-: Non hazardous
Hazard Classes and CategoriesNot Classified
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1,3-Benzenedicarbonitrile, 2-[2-[4-(diethylamino)-2-methylphenyl]diazenyl]-5-methyl-: ACTIVE
Suppliers1 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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