Basic information
- CAS
133-55-1- Standard SMILES
CN(N=O)C(=O)c1ccc(C(=O)N(C)N=O)cc1- InChIKey
CQSQUYVFNGIECQ-UHFFFAOYSA-N- Molecular formula
- C10H10N4O4
- Average molar mass
- 250.21 g/mol
- Monoisotopic mass
- 250.07020481
Names & identifiers
- Preferred name
- N,N'-dimethyl-N,N'-dinitrosoterephthalamide
- IUPAC
- 1-N,4-N-dimethyl-1-N,4-N-dinitrosobenzene-1,4-dicarboxamide
- English name
- N,N'-dimethyl-N,N'-dinitrosoterephthalamide
- Molecular formula
- C10H10N4O4
- Molecular weight
- 250.21
Names & synonyms
133-55-1N,N'-Dimethyl-N,N'-dinitrosoterephthalamideNSC-567624415D8SA89RefChem:161012205-110-4NitrosanBL 353N,N'-Dimethyl-N,N'-dinitroso-1,4-benzenedicarboxamideN,N'-Dinitroso-N,N'-dimethylterephthalamide1-N,4-N-dimethyl-1-N,4-N-dinitrosobenzene-1,4-dicarboxamideEINECS 205-110-4
Show more names
N,N'-dinitroso-N,N'-dimethylterephthalamide (paste)1,4-Benzenedicarboxamide, N1,N4-dimethyl-N1,N4-dinitroso-N.N'-Dimethyl-N.N'-dinitrosoterephthalamide ~70% in Mineral
NSC 56762BRN 2472695N,N'-Dimethyl-N,N-dinitrosoterephthalamideUNII-4415D8SA89N,N'-Dinitroso-N,N'-dimethylterephthalic acid amideN,N'-Dinitroso-N,N'-dimethylterephthalic acid diamideN,N'-Dinitroso-N,N'-dimethylterephtalsaureamid [German]1,4-Benzenedicarboxamide, N,N'-dimethyl-N,N'-dinitroso-
Database identifiers
- CAS
133-55-1- PubChem CID
- 67246
- DTXSID
DTXSID8059635- UNII
- 4415D8SA89
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 99.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 318
Physicochemical properties
- Melting point
- 108 °C · 108 °C (decomp)
- Boiling point
- 393.34 °C · 393.34°C (rough estimate)
- Density
- 1.3795 · 1.3795 (rough estimate)
- refractive index
- 1.604 · 1.6040 (estimate)
- pka
- -2.95 · -2.95±0.70(Predicted)
- FDA UNII
- 4415 D8SA89 · 4415D8SA89
- EPA Substance Registry System
- -1 · N,N'-Dimethyl-N,N'-dinitroso-1,4-benzenedicarboxamide (133-55-1)
- RIDADR
- 3224 · 3224
- TSCA
- TSCA listed
- HazardClass
- 4.1 · 4.1
- PackingGroup
- II
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
DOT LabelFlammable Solid
Fire HazardsExcerpt from ERG Guide 149 [Substances (Self-Reactive)]:
Health HazardsExcerpt from ERG Guide 149 [Substances (Self-Reactive)]:
Reactive GroupAmides and Imides
Reactivity AlertsHighly Flammable
Reactivity ProfileSelf-decomposition or self-ignition may be triggered by heat, chemical reaction, friction or impact. May be ignited by heat, sparks or flames.
Air and Water ReactionsNo rapid reaction with air. No rapid reaction with water.
Safety & protection
Fire FightingExcerpt from ERG Guide 149 [Substances (Self-Reactive)]:
First AidExcerpt from ERG Guide 149 [Substances (Self-Reactive)]:
Nonfire Spill ResponseExcerpt from ERG Guide 149 [Substances (Self-Reactive)]:
Isolation and EvacuationExcerpt from ERG Guide 149 [Substances (Self-Reactive)]:
Personal Protective Equipment (PPE)Excerpt from ERG Guide 149 [Substances (Self-Reactive)]:
Safety data
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1,4-Benzenedicarboxamide, N1,N4-dimethyl-N1,N4-dinitroso-: INACTIVE
Suppliers1 total
上海宝杨宝欣生物科技有限公司021-56698539 19921169802 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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