Basic information
- CAS
1082041-57-3- Standard SMILES
COc1cc2[nH]ncc2cc1F- InChIKey
LRZOIHJWVOMLGA-UHFFFAOYSA-N- Molecular formula
- C8H7FN2O
- Average molar mass
- 166.15 g/mol
- Monoisotopic mass
- 166.05424101
Names & identifiers
- Preferred name
- 5-fluoro-6-methoxy-1H-indazole
- IUPAC
- 5-fluoro-6-methoxy-1H-indazole
- English name
- 5-Fluoro-6-Methoxy (1H)indazole
- Molecular formula
- C8H7FN2O
- Molecular weight
- 166.15
Names & synonyms
5-fluoro-6-methoxy-1H-indazole1082041-57-35-Fluoro-6-methoxy (1H)indazoleMFCD11007884SCHEMBL24358770DTXSID801306075AKOS006302981DS-10320CS-0150550I11266F5015961H-Indazole, 5-fluoro-6-methoxy-
Database identifiers
- CAS
1082041-57-3- PubChem CID
- 53399331
- DTXSID
DTXSID801306075
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 37.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 167
Physicochemical properties
- Boiling point
- 323.8 · 323.8±22.0 °C(Predicted)
- Density
- 1.347 · 1.347±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C(protect from light)
- pka
- 13.2 · 13.20±0.40(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 280 · P280-P305+P351+P338
- HS Code
- 2933998090 · 2933998090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2933998090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers15 total
上海策嵘生物科技有限公司[email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Compound Net Biotechnology Inc.15266686121 · [email protected]
苏州亚衍医药科技有限公司17715136450 · [email protected]
湖北魏氏化学试剂股份有限公司17771898297 13125137661 · [email protected]
上海华思格医药科技有限公司13611612777 · [email protected]
泰州市众致生物科技有限公司[email protected] 15066129350 · [email protected]
武汉代为医药科技有限公司027-65318838 13646286950 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
南京凯姆铂医药科技有限公司025-66162170
华诺医药科技(广西)有限公司13005928603 · [email protected]
西安速加医药科技有限公司029-86115547 17791676824 · [email protected]
嘉兴诺华化工有限公司021-20921617 18957373295 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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