Basic information
- CAS
52476-82-1- Standard SMILES
c1ccc2c(c1)c(N1CCOCC1)nn1nnnc21- InChIKey
CTMGUNZNMOACAV-UHFFFAOYSA-N- Molecular formula
- C12H12N6O
- Average molar mass
- 256.26 g/mol
- Monoisotopic mass
- 256.10725903
Names & identifiers
- Preferred name
- 4-(Tetrazolo[5,1-a]phthalazin-6-yl)morpholine
- IUPAC
- 4-(tetrazolo[5,1-a]phthalazin-6-yl)morpholine
Names & synonyms
4-(tetrazolo[5,1-a]phthalazin-6-yl)morpholine52476-82-16-(4-morpholinyl)tetrazolo[5,1-a]phthalazine6-(morpholin-4-yl)tetrazolo[5,1-a]phthalazine4-{[1,2,3,4]TETRAZOLO[5,1-A]PHTHALAZIN-6-YL}MORPHOLINENSC228164DTXSID80310573STL432971AKOS000438302CCG-129889NSC-228164ST45019716
Show more names
ST50294144BRD-K45458267-001-01-8
Database identifiers
- CAS
52476-82-1- PubChem CID
- 313626
- DTXSID
DTXSID80310573
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 68.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 323
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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