2,6-Acridinediamine
Basic information
- CAS
3407-94-1- Standard SMILES
Nc1ccc2nc3cc(N)ccc3cc2c1- InChIKey
AXNLREBQOMGJMQ-UHFFFAOYSA-N- Molecular formula
- C13H11N3
- Average molar mass
- 209.25 g/mol
- Monoisotopic mass
- 209.09529736
Names & identifiers
- Preferred name
- 2,6-Acridinediamine
- IUPAC
- acridine-2,6-diamine
- English name
- 2,6-Acridinediamine(9CI)
- Molecular formula
- C13H11N3
- Molecular weight
- 0
Names & synonyms
Acridine-2,6-diamine2,6-Acridinediamine2,6-Acridinediamine (9CI)RefChem:445159970-951-23407-94-1Diflavine2,6-DiaminoacridineAcridine, 2,6-diamino- (8CI)Acridine, 2,6-diamino-ACRIDINE, 3,7-DIAMINO-Acridine, 2,6-diamino-(8CI)
Show more names
Diflavine【acridine】2,6-diamino-acridine
Acramine RedDiflavine (acridine)BRN 0166088starbld00475222,6-Acridinediamine(9CI)CHEMBL358136orb1986614SCHEMBL5394789
Database identifiers
- CAS
3407-94-1- PubChem CID
- 18865
- DTXSID
DTXSID70187670- ChEMBL
CHEMBL358136- EC Number
- 970-951-2
- Nikkaji
- J12.879A
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 64.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 256
Physicochemical properties
- Melting point
- 355 °C · 355°C
- Boiling point
- 338.61 °C · 338.61°C (rough estimate)
- Density
- 1.1847 · 1.1847 (rough estimate)
- refractive index
- 1.6 · 1.6000 (estimate)
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
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
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Related reactions
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Compound notes
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