Propanedinitrile, 2-((4-(ethyl(3-phenoxy-2-(((phenylamino)carbonyl)oxy)propyl)amino)-2-methylphenyl)methylene)-
Basic information
- CAS
32089-70-6- Standard SMILES
CCN(CC(COc1ccccc1)OC(=O)Nc1ccccc1)c1ccc(C=C(C#N)C#N)c(C)c1- InChIKey
ZBZJWLWVYZLFJA-UHFFFAOYSA-N- Molecular formula
- C29H28N4O3
- Average molar mass
- 480.6 g/mol
- Monoisotopic mass
- 480.21614077
Names & identifiers
- Preferred name
- Propanedinitrile, 2-((4-(ethyl(3-phenoxy-2-(((phenylamino)carbonyl)oxy)propyl)amino)-2-methylphenyl)methylene)-
- IUPAC
- [1-[4-(2,2-dicyanoethenyl)-N-ethyl-3-methylanilino]-3-phenoxypropan-2-yl] N-phenylcarbamate
- English name
- 2-[4-(2,2-dicyanovinyl)-N-ethyl-3-methylanilino]-1-(phenoxymethyl)ethyl carbanilate
- Molecular formula
- C29H28N4O3
- Molecular weight
- 480.56
Names & synonyms
EINECS 250-918-2DTXSID50885526Propanedinitrile, ((4-(ethyl(2-(((phenylamino)carbonyl)oxy)-3-phenoxypropyl)amino)-2-methylphenyl)methylene)-Propanedinitrile, [[4-[ethyl[2-[[(phenylamino)carbonyl]oxy]-3-phenoxypropyl]amino]-2-methylphenyl]methylene]-Propanedinitrile, 2-((4-(ethyl(3-phenoxy-2-(((phenylamino)carbonyl)oxy)propyl)amino)-2-methylphenyl)methylene)-Propanedinitrile, 2-[[4-[ethyl[3-phenoxy-2-[[(phenylamino)carbonyl]oxy]propyl]amino]-2-methylphenyl]methylene]-RefChem:868903DTXCID20102489532089-70-62-[4-(2,2-Dicyanovinyl)-N-ethyl-3-methylanilino]-1-(phenoxymethyl)ethyl carbanilate2-(4-(2,2-Dicyanovinyl)-N-ethyl-3-methylanilino)-1-(phenoxymethyl)ethyl carbanilateZBZJWLWVYZLFJA-UHFFFAOYSA-N
Show more names
2-[[4-[Ethyl[2-[[(phenylamino)carbonyl]oxy]-3-phenoxypropyl]amino]-2-methylphenyl]methylene]propanedinitrile[[4-[ethyl[2-[[(phenylamino) carbonyl]oxy]-3-phenoxypropyl]amino]-2-methylphenyl]methylene]-Propanedinitrile
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 98.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 11
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 795
Physicochemical properties
- EPA Substance Registry System
- 4 · Propanedinitrile, [[4-[ethyl[2-[[(phenylamino)carbonyl]oxy]-3-phenoxypropyl]amino]-2-methylphenyl]methylene]- (32089-70-6)
- 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.
Hazard information
Regulatory InformationChemical: Propanedinitrile, [[4-[ethyl[2-[[(phenylamino)carbonyl]oxy]-3-phenoxypropyl]amino]-2-methylphenyl]methylene]-
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationPropanedinitrile, 2-[[4-[ethyl[3-phenoxy-2-[[(phenylamino)carbonyl]oxy]propyl]amino]-2-methylphenyl]methylene]-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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