Basic information
- Standard SMILES
Nc1cccc2cnn(C3CCCCO3)c12- InChIKey
VWVNXVCFAWCDRM-UHFFFAOYSA-N- Molecular formula
- C12H15N3O
- Average molar mass
- 217.27 g/mol
Names & identifiers
- Preferred name
- 1-(Tetrahydro-2H-pyran-2-yl)-1H-indazol-7-amine
- IUPAC
- 1-(oxan-2-yl)indazol-7-amine
- English name
- 1-(Tetrahydro-2H-pyran-2-yl)-1H-indazol-7-amine
- Molecular formula
- C12H15N3O
- Molecular weight
- 217.27
Names & synonyms
1-(Tetrahydro-2H-pyran-2-yl)-1H-indazol-7-amine1053655-60-91-(oxan-2-yl)-1H-indazol-7-amine7-Amino-1-(tetrahydro-2H-pyran-2-yl)-1H-indazoleMFCD106991721-tetrahydropyran-2-ylindazol-7-amineAKOS0158546691H-Indazol-7-amine, 1-(tetrahydro-2H-pyran-2-yl)-
Database identifiers
- CAS
1053655-60-9
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 53.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 248
Physicochemical properties
- Boiling point
- 428.7 · 428.7±35.0 °C(Predicted)
- Density
- 1.36 · 1.36±0.1 g/cm3(Predicted)
- pka
- 3.56 · 3.56±0.10(Predicted)
- HS Code
- 2933998090 · 2933998090
Safety & regulation
Safety data
- hs_code
- 2933998090
Chemistry & industry
Suppliers2 total
北京零式京安科技有限责任公司10-61256048 13810278579 · [email protected]
河北唯特医药科技有限公司13180081292 13180081292 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Linked notes
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