1,2-Di-tert-butyl 1,2,3,6-tetrahydropyridazine-1,2-dicarboxylate
Basic information
- CAS
13051-19-9- Standard SMILES
CC(C)(C)OC(=O)N1CC=CCN1C(=O)OC(C)(C)C- InChIKey
ZQCNMSTXSXKVNU-UHFFFAOYSA-N- Molecular formula
- C14H24N2O4
- Average molar mass
- 284.35 g/mol
- Monoisotopic mass
- 284.17360725
Names & identifiers
- Preferred name
- 1,2-Di-tert-butyl 1,2,3,6-tetrahydropyridazine-1,2-dicarboxylate
- IUPAC
- ditert-butyl 3,6-dihydropyridazine-1,2-dicarboxylate
Names & synonyms
1,2-di-tert-butyl 1,2,3,6-tetrahydropyridazine-1,2-dicarboxylateRefChem:411489850-371-513051-19-9di-tert-butyl 3,6-dihydropyridazine-1,2-dicarboxylateditert-butyl 3,6-dihydropyridazine-1,2-dicarboxylate1,2-Pyridazinedicarboxylic acid, 3,6-dihydro-, 1,2-bis(1,1-dimethylethyl) ester1,2-Pyridazinedicarboxylicacid, 3,6-dihydro-, 1,2-bis(1,1-dimethylethyl) esterMFCD24465899NSC109949SCHEMBL6203338DTXSID10296573
Show more names
AKOS033976304NSC-109949AS-78241D92860EN300-314051F843882Z15086877111,2-di-tert-butyl1,2,3,6-tetrahydropyridazine-1,2-dicarboxylate
Database identifiers
- CAS
13051-19-9- PubChem CID
- 269290
- DTXSID
DTXSID10296573- EC Number
- 850-371-5
- Nikkaji
- J2.662.311A
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 59.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 366
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, 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 CategoriesSkin Irrit. 2 (100%)
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Related reactions
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Compound notes
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