Basic information
- CAS
697230-91-4- Standard SMILES
NC1=NN=C2C=CC=C(F)C12- InChIKey
KHBNMZVBAARWRK-UHFFFAOYSA-N- Molecular formula
- C7H6FN3
- Average molar mass
- 151.14 g/mol
- Monoisotopic mass
- 151.05457537
Names & identifiers
- Preferred name
- 4-fluoro-3aH-indazol-3-amine
- IUPAC
- 4-fluoro-3aH-indazol-3-amine
- English name
- 3aH-Indazol-3-amine,4-fluoro-(9CI)
- Molecular formula
- C7H6FN3
- Molecular weight
- 151.14
Names & synonyms
4-fluoro-3aH-indazol-3-amine697230-91-43aH-Indazol-3-amine, 4-fluoro-MFCD05855527DTXSID70406398AKOS000297163CS-0366588F180173aH-Indazol-3-amine,4-fluoro-(9CI)
Database identifiers
- CAS
697230-91-4- PubChem CID
- 4771041
- DTXSID
DTXSID70406398
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 50.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 312
Physicochemical properties
- Boiling point
- 290.5 · 290.5±50.0 °C(Predicted)
- Density
- 1.55 · 1.55±0.1 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 6.53 · 6.53±0.40(Predicted)
- 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
Chemistry & industry
Suppliers6 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
德州博腾精细化工有限公司[email protected]
ATK CHEMICAL COMPANY LIMITED+undefined-21-51877795 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
北京海特乐思克科技有限公司15210893940; 15116916250 · [email protected]
凌源贝卞森生物科技有限公司18642120371 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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