CAS No.: 94-93-9 — N,N'-Bis(salicylidene)ethylenediamine (N,N′-双(亚水杨基)乙二胺)

1. Primary Information

English name:	N,N'-Bis(salicylidene)ethylenediamine
CAS No.:	94-93-9
Molecular formula:	C₁₆H₁₆N₂O₂
Molecular weight:	268.31 g/mol
SMILES:	C1=CC=C(C(=C1)C=NCCN=CC2=CC=CC=C2O)O
Structural class:
Other identifiers:	disalicylaldehyde ethylenediamine N,N'-bis(salicylideneamino)ethane N,N'-ethylenebis(salicylimine) salen tetrahydrosalen

2. Suppliers & Pricing

Supplier	Pack size	Purity	Price (CNY)	Storage conditions	Lead time	Notes
Kehua Intelligence	100mg	HPLC≥98%	120	RT	in stock	-
Kehua Intelligence	5g	99%	40	RT	in stock	-
Kehua Intelligence	25g	99%	120	RT	in stock	-
Kehua Intelligence	100g	99%	432	RT	in stock	-

3. Structures

3.1 2D structure

3.2 3D structure

-1 -2 -3 36 37 0 0 0 0 0 0 0999 V2000 5.3060 1.0608 -1.2657 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3060 1.0557 1.2681 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4157 1.2380 0.1437 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4286 1.2301 -0.1458 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6898 2.4245 -0.3008 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7040 2.4220 0.3017 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5372 0.0801 0.0245 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5442 0.0695 -0.0268 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8414 0.0568 -0.4697 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8383 0.0539 0.4709 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6359 1.1782 -0.2961 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6362 1.1823 0.2988 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0803 -0.9580 0.8365 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0741 -0.9539 -0.8364 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6887 -1.0049 -0.1517 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6824 -1.0097 0.1516 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9276 -2.0195 1.1542 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9182 -2.0176 -1.1555 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2317 -2.0429 0.6601 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2223 -2.0455 -0.6615 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6151 2.4313 -1.3956 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2132 3.3350 0.0154 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6292 2.4269 1.3966 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2302 3.3312 -0.0141 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0265 1.9838 -0.9436 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0327 1.9840 0.9476 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0699 -0.9692 1.2368 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0640 -0.9604 -1.2357 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7071 -1.0365 -0.5297 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7007 -1.0449 0.5296 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5722 -2.8281 1.7863 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5603 -2.8244 -1.7886 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8912 -2.8696 0.9074 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8793 -2.8738 -0.9099 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2282 0.8716 -1.5101 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2277 0.8636 1.5121 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 35 1 0 0 0 0 2 10 1 0 0 0 0 2 36 1 0 0 0 0 3 5 1 0 0 0 0 3 11 2 0 0 0 0 4 6 1 0 0 0 0 4 12 2 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 5 22 1 0 0 0 0 6 23 1 0 0 0 0 6 24 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 7 13 2 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 8 14 2 0 0 0 0 9 15 2 0 0 0 0 10 16 2 0 0 0 0 11 25 1 0 0 0 0 12 26 1 0 0 0 0 13 17 1 0 0 0 0 13 27 1 0 0 0 0 14 18 1 0 0 0 0 14 28 1 0 0 0 0 15 19 1 0 0 0 0 15 29 1 0 0 0 0 16 20 1 0 0 0 0 16 30 1 0 0 0 0 17 19 2 0 0 0 0 17 31 1 0 0 0 0 18 20 2 0 0 0 0 18 32 1 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0

4. International Nomenclature & Identifiers

4.1 IUPAC Name

2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol

4.2 InChI

InChI=1S/C16H16N2O2/c19-15-7-3-1-5-13(15)11-17-9-10-18-12-14-6-2-4-8-16(14)20/h1-8,11-12,19-20H,9-10H2

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)