Basic information
- CAS
103460-89-5- Standard SMILES
CC1CN(c2c(F)cc3c(=O)c(C(=O)O)cn(C4CC4)c3c2F)CCN1- InChIKey
ZHKOPMSOBOQYRH-UHFFFAOYSA-N- Molecular formula
- C18H19F2N3O3
- Average molar mass
- 363.4 g/mol
- Monoisotopic mass
- 363.13944791
Names & identifiers
- Preferred name
- 1-Cyclopropyl-6,8-difluoro-7-(3-methylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
- IUPAC
- 1-cyclopropyl-6,8-difluoro-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid
- English name
- 8-Demethoxy-8-fluoro Gatifloxacin
- Molecular formula
- C18H19F2N3O3
- Molecular weight
- 363.36
Names & synonyms
103460-89-51-Cyclopropyl-6,8-difluoro-7-(3-methylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid8-Demethoxy-8-fluoro GatifloxacinAMQ2Gatifloxacin Impurity 4CP 1055321-cyclopropyl-6,8-difluoro-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acidPD125275Gatifloxacin Impurity IMFCD183793161-Cyclopropyl-6,8-difluoro-1,4-dihydro-7-(3-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic Acid3-Quinolinecarboxylic acid, 1-cyclopropyl-6,8-difluoro-1,4-dihydro-7-(3-methyl-1-piperazinyl)-4-oxo-
Show more names
Gatifloxacin Impurity1375Pirtobrutinib Impurity 11Gatifloxacin Desmethoxy 8-Fluoro8-Demethoxy-8-Fuoro Gatifloxacin
1-Cyclopropyl-6,8-difluoro-7-(3-methylpiperazinyl)-4-oxohydroquinoline-3-carboxylic acid1-Cyclopropyl-6,8-difluoro-7-(3-methylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylicacid1-cyclopropyl-6,8-difluoro-7-(3-methylpiperazin-1-yl)-4-oxo-quinoline-3-carboxylic acidAMQ 2ZHKOPMSOBOQYRH-UHFFFAOYSA-N8-Fluoro GatifloxacinQBS9PC7SBD3-Quinolinecarboxylicacid, 1-cyclopropyl-6,8-difluoro-1,4-dihydro-7-(3-methyl-1-piperazinyl)-4-oxo-
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 72.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 639
Physicochemical properties
- Melting point
- 222 · 222-250.66℃
- Boiling point
- 566.9 · 566.9±50.0 °C(Predicted)
- Density
- 1.447 · 1.447±0.06 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2–8 °C
- solubility
- Aqueous Base (Slightly), Chloroform (Slightly, Sonicated),DMSO (Slightly, Heated)
- form
- Solid
- pka
- 6.4 · 6.40±0.50(Predicted)
- color
- Light Yellow to Yellow
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Applications
Uses8-Demethoxy-8-fluoro Gatifloxacin can act as a fluoroquinolone used in the synthesis of Gatifloxacin (G250000).
Suppliers47 total
上海策嵘生物科技有限公司[email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
艾吉析科技（上海）有限公司17717235263 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
怀化元研达生物技术有限责任公司18711085600 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
怀化元研达生物技术有限责任公司18711085600; 18229999901 · [email protected]
河南阿尔法化工有限公司0371-55013243 15324716602 · [email protected]
成都普思生物科技股份有限公司028-85370565-229 18080489829 · [email protected]
上海泰坦科技股份有限公司400-6009262 15618770481 · [email protected]
上海尺水药物研究有限公司[email protected] 13564957716 · [email protected]
Related reactions
3 records
Compound notes
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