Basic information
- CAS
49612-09-1- Standard SMILES
NNc1ccnc2ccc(F)cc12- InChIKey
IHJGCOWFOYAATP-UHFFFAOYSA-N- Molecular formula
- C9H8FN3
- Average molar mass
- 177.18 g/mol
- Monoisotopic mass
- 177.07022543
Names & identifiers
- Preferred name
- 6-Fluoro-4-hydrazinoquinoline
- IUPAC
- (6-fluoroquinolin-4-yl)hydrazine
- English name
- 6-Fluoro-4-hydrazinoquinoline
- Molecular formula
- C9H8FN3
- Molecular weight
- 177.18
Names & synonyms
6-Fluoro-4-hydrazinoquinoline49612-09-16-fluoro-4-hydrazinylquinoline(6-fluoroquinolin-4-yl)hydrazine(6-Fluoro-quinolin-4-yl)-hydrazine6-fluoro-4-quinolylhydrazineSCHEMBL2480030DTXSID50588888IHJGCOWFOYAATP-UHFFFAOYSA-NMFCD00272476SBB089260AKOS002683752
Show more names
(6-fluoro-4-quinolinyl)hydrazineQuinoline, 6-fluoro-4-hydrazinyl-
AB05760
Database identifiers
- CAS
49612-09-1- PubChem CID
- 17039615
- DTXSID
DTXSID50588888
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 50.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 176
Physicochemical properties
- form
- solid
- InChI
- 1S/C9H8FN3/c10-6-1-2-8-7(5-6)9(13-11)3-4-12-8/h1-5H,11H2,(H,12,13)
- InChIKey
- IHJGCOWFOYAATP-UHFFFAOYSA-N
- UNSPSC Code
- 12352101 · 12352101
- Symbol(GHS)
- 7 · GHS07,GHS09
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H400
- Precautionary statements
- 264 · P264-P273-P280-P337+P313-P391
- Hazard Codes
- Xi
- WGK Germany
- 3 · WGK 3
- Hazard Note
- Irritant
- HS Code
- 2933499090 · 2933499090
- Storage Class
- 11 · 11 - Combustible Solids
- Hazard Classifications
- 1 Eye · Aquatic Acute 1Eye Irrit. 2Skin Irrit. 2
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
- wgk
- WGK 3
- hs_code
- 2933499090
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS09
- hazard_code
- Xi
- hazard_note
- Irritant
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H315-H319-H400
- Hazard Classifications
- Aquatic Acute 1Eye Irrit. 2Skin Irrit. 2
- Precautionary statements
- P264-P273-P280-P337+P313-P391
Chemistry & industry
Suppliers5 total
Allfluoro Pharmaceutical Company Limited+86-400-0216110 +86-15958047586 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
8 records
Compound notes
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