CAS No.: 103222-12-4 — Ciprofloxacin-7-ethylenediamine (环丙沙星杂质C)

1. Primary Information

English name:	Ciprofloxacin-7-ethylenediamine
CAS No.:	103222-12-4
Molecular formula:	C₁₅H₁₆FN₃O₃
Molecular weight:	305.30 g/mol
SMILES:	C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)NCCN)F)C(=O)O
Structural class:
Other identifiers:	7-(2-aminoethylamino)-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxoquinoline-3-carboxylic acid 7-AEA-ciprofloxcin 7-ethylenediamine ciprofloxacin ciprofloxacin-7-ethylenediamine desethylene ciprofloxacin

2. Suppliers & Pricing

Supplier	Pack size	Purity	Price (CNY)	Storage conditions	Lead time	Notes
Kehua Intelligence	5mg	≥90%	992	2-8°C	in stock	-

3. Structures

3.1 2D structure

3.2 3D structure

-1 -2 -3 38 40 0 0 0 0 0 0 0999 V2000 2.1856 -3.3094 -0.3072 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.7485 -2.3174 -0.2051 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9257 -1.0854 0.5788 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0942 1.0150 -0.3097 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9221 1.2996 0.2477 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4772 -0.8688 0.0018 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4033 1.3760 0.2512 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3377 2.6478 0.4151 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6574 3.1766 -0.5639 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7208 3.7664 -0.4961 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1039 0.1422 0.1094 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2972 1.1692 0.2256 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7098 -1.1232 -0.0487 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2991 0.2010 0.1229 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9707 0.0211 0.0819 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1922 -1.2348 -0.0687 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0686 -0.9574 -0.0164 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0622 -2.2831 -0.1885 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4518 -2.1955 -0.1718 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4334 0.0692 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1746 0.3693 0.1587 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6764 0.1216 0.1008 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1817 2.8940 1.4607 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8937 2.6150 -1.4595 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4782 3.7709 -0.1809 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8254 4.7551 -0.0663 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3864 3.5689 -1.3273 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8171 2.1139 0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7924 1.1500 0.2894 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3999 -3.2587 -0.3108 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9958 -1.7347 -0.0982 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9228 0.8294 1.1226 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8977 1.0676 -0.6414 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9535 -0.3423 -0.8527 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9832 -0.5694 0.8941 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9066 -1.0912 0.5951 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1463 1.8177 1.1333 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1195 2.0268 -0.4804 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 2 16 2 0 0 0 0 3 20 1 0 0 0 0 3 36 1 0 0 0 0 4 20 2 0 0 0 0 5 8 1 0 0 0 0 5 11 1 0 0 0 0 5 12 1 0 0 0 0 6 17 1 0 0 0 0 6 21 1 0 0 0 0 6 31 1 0 0 0 0 7 22 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 13 1 0 0 0 0 11 14 2 0 0 0 0 12 15 2 0 0 0 0 12 28 1 0 0 0 0 13 16 1 0 0 0 0 13 18 2 0 0 0 0 14 17 1 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 17 19 2 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 21 22 1 0 0 0 0 21 32 1 0 0 0 0 21 33 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0

4. International Nomenclature & Identifiers

4.1 IUPAC Name

7-(2-aminoethylamino)-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid

4.2 InChI

InChI=1S/C15H16FN3O3/c16-11-5-9-13(6-12(11)18-4-3-17)19(8-1-2-8)7-10(14(9)20)15(21)22/h5-8,18H,1-4,17H2,(H,21,22)

1. Primary Information

2. Suppliers & Pricing

3. Structures

3.1 2D structure

3.2 3D structure

4. International Nomenclature & Identifiers

4.1 IUPAC Name

4.2 InChI

4.3 InChIKey

4.4 Canonical SMILES

4.5 Isomeric SMILES

4.6 SDF file

5. Spectroscopic data

5.1 ¹³C nuclear magnetic resonance (¹³C NMR)

5.2 ¹H nuclear magnetic resonance (¹H NMR)

5.3 Mass spectrometry (MS)

5.4 Infrared spectroscopy (IR)

5.5 Ultraviolet/visible spectroscopy (UV/Vis)

1. Primary Information

2. Suppliers & Pricing

3. Structures

3.1 2D structure

3.2 3D structure

4. International Nomenclature & Identifiers

4.1 IUPAC Name

4.2 InChI

4.3 InChIKey

4.4 Canonical SMILES

4.5 Isomeric SMILES

4.6 SDF file

5. Spectroscopic data

5.1 13C nuclear magnetic resonance (13C NMR)

5.2 1H nuclear magnetic resonance (1H NMR)

5.3 Mass spectrometry (MS)

5.4 Infrared spectroscopy (IR)

5.5 Ultraviolet/visible spectroscopy (UV/Vis)

5.1 ¹³C nuclear magnetic resonance (¹³C NMR)

5.2 ¹H nuclear magnetic resonance (¹H NMR)