531901
7-Chloro-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxoquinoline-3-carboxylic acid
96%
Manufacturer: Sigma Aldrich
CAS Number: 86393-33-1
Synonym(S): Fluoroquinolonic acid, Q-Acid
Select a Size
| Pack Size | SKU | Availability | Price |
|---|---|---|---|
| 25 G | 531901-25-G | In Stock | ₹ 14,592.10 |
531901 - 25 G
In Stock
Quantity
1
Base Price: ₹ 14,592.10
GST (18%): ₹ 2,626.578
Total Price: ₹ 17,218.678
Quality Level
100
Assay
96%
mp
242-245 °C (lit.)
SMILES string
OC(=O)C1=CN(C2CC2)c3cc(Cl)c(F)cc3C1=O
InChI
1S/C13H9ClFNO3/c14-9-4-11-7(3-10(9)15)12(17)8(13(18)19)5-16(11)6-1-2-6/h3-6H,1-2H2,(H,18,19)
InChI key
ISPVACVJFUIDPD-UHFFFAOYSA-N
Other Options
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Description
- General description: 7-Chloro-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxoquinoline-3-carboxylic acid, also known as fluoroquinolonic acid, can be prepared from ethyl 2,4-dichloro-5-fluorobenzoylacetate. It is formed as an intermediate during the synthesis of ciprofloxacin hydrochloride, a fluorinated quinolone antibacterial drug.[1]
SAFETY INFORMATION
Pictograms
Signal Word
Warning
Hazard Statements
Precautionary Statements
Hazard Classifications
Acute Tox. 4 Oral - Aquatic Chronic 3
WGK
WGK 2
Flash Point(F)
Not applicable
Flash Point(C)
Not applicable
Compare Similar Items
Show Difference
Quality Level: 100
Assay: 96%
mp: 242-245 °C (lit.)
SMILES string: OC(=O)C1=CN(C2CC2)c3cc(Cl)c(F)cc3C1=O
InChI: 1S/C13H9ClFNO3/c14-9-4-11-7(3-10(9)15)12(17)8(13(18)19)5-16(11)6-1-2-6/h3-6H,1-2H2,(H,18,19)
InChI key: ISPVACVJFUIDPD-UHFFFAOYSA-N
Quality Level:
100
Assay:
96%
mp:
242-245 °C (lit.)
SMILES string:
OC(=O)C1=CN(C2CC2)c3cc(Cl)c(F)cc3C1=O
InChI:
1S/C13H9ClFNO3/c14-9-4-11-7(3-10(9)15)12(17)8(13(18)19)5-16(11)6-1-2-6/h3-6H,1-2H2,(H,18,19)
InChI key:
ISPVACVJFUIDPD-UHFFFAOYSA-N
Quality Level: 100
Assay: __
mp: >350 °C (lit.)
SMILES string: CC(C)(C)c1cc2\C=N\[C@@H]3CCCC[C@H]3\N=C\c4cc(cc(c4O[Cr](Cl)Oc2c(c1)C(C)(C)C)C(C)(C)C)C(C)(C)C
InChI: 1S/C36H54N2O2.ClH.Cr/c1-33(2,3)25-17-23(31(39)27(19-25)35(7,8)9)21-37-29-15-13-14-16-30(29)38-22-24-18-26(34(4,5)6)20-28(32(24)40)36(10,11)12;;/h17-22,29-30,39-40H,13-16H2,1-12H3;1H;/q;;+3/p-3/b37-21+,38-22+;;/t29-,30-;;/m1../s1
InChI key: ZWANLSXDTHQDNO-OHRASPNLSA-K
Quality Level:
100
Assay:
__
mp:
>350 °C (lit.)
SMILES string:
CC(C)(C)c1cc2\C=N\[C@@H]3CCCC[C@H]3\N=C\c4cc(cc(c4O[Cr](Cl)Oc2c(c1)C(C)(C)C)C(C)(C)C)C(C)(C)C
InChI:
1S/C36H54N2O2.ClH.Cr/c1-33(2,3)25-17-23(31(39)27(19-25)35(7,8)9)21-37-29-15-13-14-16-30(29)38-22-24-18-26(34(4,5)6)20-28(32(24)40)36(10,11)12;;/h17-22,29-30,39-40H,13-16H2,1-12H3;1H;/q;;+3/p-3/b37-21+,38-22+;;/t29-,30-;;/m1../s1
InChI key:
ZWANLSXDTHQDNO-OHRASPNLSA-K
Quality Level: 100
Assay: __
mp: 250-255 °C (lit.)
SMILES string: CC(C)(C)c1cc2\C=N\[C@@H]3CCCC[C@H]3\N=C\c4cc(cc(c4O[Al](Cl)Oc2c(c1)C(C)(C)C)C(C)(C)C)C(C)(C)C
InChI: 1S/C36H54N2O2.Al.ClH/c1-33(2,3)25-17-23(31(39)27(19-25)35(7,8)9)21-37-29-15-13-14-16-30(29)38-22-24-18-26(34(4,5)6)20-28(32(24)40)36(10,11)12;;/h17-22,29-30,39-40H,13-16H2,1-12H3;;1H/q;+3;/p-3/b37-21+,38-22+;;/t29-,30-;;/m1../s1
InChI key: KGVBCKDZFMLRMA-OHRASPNLSA-K
Quality Level:
100
Assay:
__
mp:
250-255 °C (lit.)
SMILES string:
CC(C)(C)c1cc2\C=N\[C@@H]3CCCC[C@H]3\N=C\c4cc(cc(c4O[Al](Cl)Oc2c(c1)C(C)(C)C)C(C)(C)C)C(C)(C)C
InChI:
1S/C36H54N2O2.Al.ClH/c1-33(2,3)25-17-23(31(39)27(19-25)35(7,8)9)21-37-29-15-13-14-16-30(29)38-22-24-18-26(34(4,5)6)20-28(32(24)40)36(10,11)12;;/h17-22,29-30,39-40H,13-16H2,1-12H3;;1H/q;+3;/p-3/b37-21+,38-22+;;/t29-,30-;;/m1../s1
InChI key:
KGVBCKDZFMLRMA-OHRASPNLSA-K
Quality Level: 100
Assay: __
mp: >350 °C (lit.)
SMILES string: CC(C)(C)c1cc2\C=N\[C@H]3CCCC[C@@H]3\N=C\c4cc(cc(c4O[Al](Cl)Oc2c(c1)C(C)(C)C)C(C)(C)C)C(C)(C)C
InChI: 1S/C36H54N2O2.Al.ClH/c1-33(2,3)25-17-23(31(39)27(19-25)35(7,8)9)21-37-29-15-13-14-16-30(29)38-22-24-18-26(34(4,5)6)20-28(32(24)40)36(10,11)12;;/h17-22,29-30,39-40H,13-16H2,1-12H3;;1H/q;+3;/p-3/b37-21+,38-22+;;/t29-,30-;;/m0../s1
InChI key: KGVBCKDZFMLRMA-RUIQGICGSA-K
Quality Level:
100
Assay:
__
mp:
>350 °C (lit.)
SMILES string:
CC(C)(C)c1cc2\C=N\[C@H]3CCCC[C@@H]3\N=C\c4cc(cc(c4O[Al](Cl)Oc2c(c1)C(C)(C)C)C(C)(C)C)C(C)(C)C
InChI:
1S/C36H54N2O2.Al.ClH/c1-33(2,3)25-17-23(31(39)27(19-25)35(7,8)9)21-37-29-15-13-14-16-30(29)38-22-24-18-26(34(4,5)6)20-28(32(24)40)36(10,11)12;;/h17-22,29-30,39-40H,13-16H2,1-12H3;;1H/q;+3;/p-3/b37-21+,38-22+;;/t29-,30-;;/m0../s1
InChI key:
KGVBCKDZFMLRMA-RUIQGICGSA-K