Basic information
- CAS
2368909-53-7- Standard SMILES
Oc1c(Cl)c(F)cc2c1cnn2C1CCCCO1- InChIKey
QQRLHRRUJVOCNO-UHFFFAOYSA-N- Molecular formula
- C12H12ClFN2O2
- Average molar mass
- 270.69 g/mol
- Monoisotopic mass
- 270.0571335
Names & identifiers
- Preferred name
- 5-Chloro-6-fluoro-1-tetrahydropyran-2-yl-indazol-4-ol
- IUPAC
- 5-chloro-6-fluoro-1-(oxan-2-yl)indazol-4-ol
- English name
- 5-Chloro-6-fluoro-1-(tetrahydro-pyran-2-yl)-1H-indazol-4-ol
- Molecular formula
- C12H12ClFN2O2
- Molecular weight
- 270.69
Names & synonyms
2368909-53-75-Chloro-6-fluoro-1-tetrahydropyran-2-yl-indazol-4-ol5-Chloro-6-fluoro-1-(tetrahydro-2H-pyran-2-yl)-1H-indazol-4-olSCHEMBL21196113MFCD34625337DB-413910H267555-Chloro-6-fluoro-1-(tetrahydro-pyran-2-yl)-1H-indazol-4-ol5-chloro-6-fluoro-1 -(tetrahydro-2H-pyran-2-yl)-1 H-indazol-4-ol1H-Indazol-4-ol, 5-chloro-6-fluoro-1-(tetrahydro-2H-pyran-2-yl)-5-chloro-6-fluoro-1 -(tetrahydro-2H-pyran-2-yl)-1 H-indazol-4-ol 、
Database identifiers
- CAS
2368909-53-7- PubChem CID
- 139346006
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 47.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 310
Physicochemical properties
- Boiling point
- 435.9 · 435.9±45.0 °C(Predicted)
- Density
- 1.57 · 1.57±0.1 g/cm3(Predicted)
- pka
- 5.39 · 5.39±0.50(Predicted)
Chemistry & industry
Suppliers7 total
宁波苯康基石医药科技有限公司15990591583
武汉艾瑞尔化学科技有限公司18986259541 18986259541 · [email protected]
武汉凯美克化学科技有限公司027-87342388 18086026008 · [email protected]
诺圣华控股集团有限公司+86-023-62871537 · [email protected]
南京世洲生物科技有限公司17301488900 · [email protected]
南京毕科生物科技有限公司025-58906079 17352406906 · [email protected]
Nanjing Bicbiotechnology Co., Ltd+86-2552131256 +86-18251840740 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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