Basic information
- CAS
2876-22-4- Standard SMILES
Nc1cccc2nc3ccccc3nc12- InChIKey
QWUFXJHVFNRNCU-UHFFFAOYSA-N- Molecular formula
- C12H9N3
- Average molar mass
- 195.22 g/mol
- Monoisotopic mass
- 195.07964729
Names & identifiers
- Preferred name
- 1-Aminophenazine
- IUPAC
- phenazin-1-amine
- English name
- phenazin-1-ylamine
- Molecular formula
- C12H9N3
- Molecular weight
- 195.22
Names & synonyms
1-Phenazinamine2876-22-41-AminophenazineQ98GLL9GUCDTXSID50182941RefChem:1054857DTXCID90105432220-719-5phenazin-1-aminePhenazin-1-ylaminePhenazin-1(5H)-imineMFCD00705275
Show more names
755710-53-3Phenazine, 1-amino-CCRIS 30211-Phenazinamine (9CI)EINECS 220-719-5aminophenazine1-Aminophenazin1-amino phenazine
Database identifiers
- CAS
2876-22-4、755710-53-3- PubChem CID
- 76138
- DTXSID
DTXSID50182941- UNII
- Q98GLL9GUC
- EC Number
- 220-719-5
- Nikkaji
- J80.584J
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 51.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 231
Physicochemical properties
- Melting point
- 201 · 201-290 °C
- Boiling point
- 321.89 °C · 321.89°C (rough estimate)
- Density
- 1.2142 · 1.2142 (rough estimate)
- refractive index
- 1.699 · 1.6990 (estimate)
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- pka
- 3.4 · 3.40±0.30(Predicted)
- Appearance
- Brown to reddish brown Solid
- FDA UNII
- 98 GLL9GUC · Q98GLL9GUC
- Toxicity
- 9200 nmol/vial · slt-orl-uns-dmg 9200 nmol/vial MUREAV 369,75,1996
Safety & regulation
Safety data
- Toxicity
- slt-orl-uns-dmg 9200 nmol/vial MUREAV 369,75,1996
Chemistry & industry
Suppliers30 total
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
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Related reactions
2 records
Compound notes
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