6-Hydrazino[1,2,4]triazolo[3,4-a]phthalazine
Basic information
- CAS
21517-30-6- Standard SMILES
NNc1nn2cnnc2c2ccccc12- InChIKey
YDEVRXFFVFPHBM-UHFFFAOYSA-N- Molecular formula
- C9H8N6
- Average molar mass
- 200.2 g/mol
- Monoisotopic mass
- 200.08104428
Names & identifiers
- Preferred name
- 6-Hydrazino[1,2,4]triazolo[3,4-a]phthalazine
- IUPAC
- [1,2,4]triazolo[3,4-a]phthalazin-6-ylhydrazine
- English name
- AKOS BBS-00002550
- Molecular formula
- C9H8N6
- Molecular weight
- 200.2
Names & synonyms
6-Hydrazino[1,2,4]triazolo[3,4-a]phthalazine21517-30-6[1,2,4]triazolo[3,4-a]phthalazin-6-ylhydrazineMFCD004900407-hydro-1,2,4-triazolo[3,4-a]phthalazine-5-ylhydrazineAKOS BBS-00002550NSC270402Oprea1_000218DTXSID50313455CHEMBRDG-BB 4102438SBB039840AKOS000271366
Show more names
NSC-270402ST50160558H425906-hydrazinyl[1,2,4]triazolo[3,4-a]phthalazineF0613061,2,4-Triazolo[3,4-a]phthalazine, 6-hydrazinyl-6-hydrazineyl-[1,2,4]triazolo[3,4-a]phthalazine6-hydrazino[1,2,4]triazolo[3,4-a]phthalazine(SALTDATA: FREE)
Database identifiers
- CAS
21517-30-6- PubChem CID
- 321070
- DTXSID
DTXSID50313455
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 81.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 235
Physicochemical properties
- Melting point
- 299 · 299-301 °C
- Boiling point
- 546.2 · 546.2±33.0 °C(Predicted)
- Density
- 1.69 · 1.69±0.1 g/cm3(Predicted)
- pka
- 1.9 · 1.90±0.20(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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