8-Hydrazino-1,3-dimethyl-7-(1-naphthylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Basic information
- CAS
476480-41-8- Standard SMILES
Cn1c(=O)c2c(nc(NN)n2Cc2cccc3ccccc23)n(C)c1=O- InChIKey
DRFXAYLPHRBXET-UHFFFAOYSA-N- Molecular formula
- C18H18N6O2
- Average molar mass
- 350.4 g/mol
- Monoisotopic mass
- 350.14912384
Names & identifiers
- Preferred name
- 8-Hydrazino-1,3-dimethyl-7-(1-naphthylmethyl)-3,7-dihydro-1H-purine-2,6-dione
- IUPAC
- 8-hydrazinyl-1,3-dimethyl-7-(naphthalen-1-ylmethyl)purine-2,6-dione
Names & synonyms
476480-41-8RefChem:5481198-Hydrazino-1,3-dimethyl-7-(1-naphthylmethyl)-3,7-dihydro-1H-purine-2,6-dione631-714-68-hydrazinyl-1,3-dimethyl-7-(naphthalen-1-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione8-hydrazino-1,3-dimethyl-7-(naphthylmethyl)-1,3,7-trihydropurine-2,6-dione8-hydrazinyl-1,3-dimethyl-7-[(naphthalen-1-yl)methyl]-2,3,6,7-tetrahydro-1H-purine-2,6-dione8-hydrazinyl-1,3-dimethyl-7-(naphthalen-1-ylmethyl)purine-2,6-dioneSBB084995STK984063AKOS001443548CS-0300814
Show more names
ST51078427Z2857491268-hydrazinyl-1,3-dimethyl-7-(naphthalen-1-ylmethyl)-1H-purine-2,6(3H,7H)-dione
Database identifiers
- CAS
476480-41-8- PubChem CID
- 4435372
- EC Number
- 631-714-6
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 96.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 572
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
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P264, P270, P301+P316, P321, P330, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 3 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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