N,N'-Bis(3-nitrophenyl)terephthalamide
Basic information
- CAS
34062-85-6- Standard SMILES
O=C(Nc1cccc([N+](=O)[O-])c1)c1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2)cc1- InChIKey
ZYQYDMAEGZCUPD-UHFFFAOYSA-N- Molecular formula
- C20H14N4O6
- Average molar mass
- 406.3 g/mol
- Monoisotopic mass
- 406.09133418
Names & identifiers
- Preferred name
- N,N'-Bis(3-nitrophenyl)terephthalamide
- IUPAC
- 1-N,4-N-bis(3-nitrophenyl)benzene-1,4-dicarboxamide
- English name
- N,N'-Bis(3-nitrophenyl)terephthalamide
- Molecular formula
- C20H14N4O6
- Molecular weight
- 406.35
Names & synonyms
N,N'-bis(3-nitrophenyl)terephthalamideRefChem:821782666-298-5N1,N4-Bis(3-nitrophenyl)terephthalamideNSC2043281-N,4-N-bis(3-nitrophenyl)benzene-1,4-dicarboxamideSCHEMBL9329754STL260652AKOS001648236AKOS015889081NSC-204328ST011886
Show more names
N,N'-Bis--terephthalsaeure-diamid1,4-Benzenedicarboxamide, N1,N4-bis(3-nitrophenyl)-
N~1~,N~4~-bis(3-nitrophenyl)terephthalamideN,N'-bis(3-nitrophenyl)benzene-1,4-dicarboxamideN~1~,N~4~-bis(3-nitrophenyl)benzene-1,4-dicarboxamideN-(3-nitrophenyl){4-[N-(3-nitrophenyl)carbamoyl]phenyl}carboxamide
Database identifiers
- CAS
34062-85-6- PubChem CID
- 306642
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 150 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 597
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 315 · H315-H335-H318-H317
- Precautionary statements
- 280 · P280-P305+P351+P338-P310-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P264-P280-P302+P352-P321-P332+P313-P362
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS05
- Hazard statements
- H315-H335-H318-H317
- Precautionary statements
- P280-P305+P351+P338-P310-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P264-P280-P302+P352-P321-P332+P313-P362
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Related reactions
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Compound notes
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